A0A5K4F0X5_SCHMA Loading...

LSDAT_euk domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0X5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,268 aa.

						>A0A5K4F0X5_SCHMA|A0A5K4F0X5
MTEQIPFQRTSTLKHRISRTGSVGQDNNNNITGSINISSGINTGIQQQSSIRRASVMQKYMGEIEFTGLNQTARFCKLNSETPDSILRDILKRKWGLKPPTLIITVFGTDFEKKRKLKMIFKKGLWKAAESGCWIVTGGFHLGVMKLTGEAVRDYTDAYGGNRMMAFGVASWDCVTKNEILEAALHEGTAVYQSEEDEEEEAEDSEPILVDPLSQGGIKSVRSDIEERALDPNHNFFVLVDDGTTDQLKGKEAELRARFERCISLWNCASSPQEQTTTVTSQQSGPISSTTHLQQPQNGISTSSNVNNNVNLGGLQRQGSTMGGQASTTSGPQTSATSIGKTSAITGGSSSNSALSKGVSEPVVSNQPVSTASVTRGTKDKLTTESSLKPAKSGKSVGSEEEILVPMCGLVVGGDRFTLRQVYCSMIRNRCPIVVTKGTSGAADVLAFGLDAANKMASEEVVDDKDQVPLEARLESIIEEFLGDLHPDYTNYTDEVNMLCEIINEYTNLVSVFDMEEDSDLDGYVISSLLASAGSTVASDQINLEQLEITLTLNRADIAREKIFLENKKWKKGQLNDYMYQALMSDRHDFVKLFLEQGFSLEDFLTIYMLEKLYTDQLKNLNSKVAIFNKMWEYNRSHRTSKVALRDVGKVIKALVGDFYHPLYLSKEFQAKLMPEKRLEGADICQRLLGSNKLRSSQDYSNMSPSSSSSSTSSSSHHNGAICPRTLGLKDNVRFIDYNEDYDLMNLNSLHLTSPPPPLPPPPPTSTTTVIEEIGFRNPAFLECDKYGTRAIIRRGATSVEPAEKNDGDNDDDDNDYDVDDREDHDDDNEIYGSNMNGFTMNSRLPRSSTTMTTVSGEPLISSNVLRYNDKGNTMGTSTVSHLGSSRIRDGTIQQQYHLNDEGNSSRPHNTDDMSSQLKKSKYLSATRNNDNGNRNGYSSRNKHGRRPSSQTNEHDMLIPGQPLIYNATITNINRSGHSSRGPYTSLGPGHFRITGRAPLAYDATSMGTTTPIQSPKPIINDTLQFSFDNEHVQRNSVLISSIPNEKSNKPVLFEDETINKPSRSCLMSCIQRITSFCSRLFRCNTDTKKVNKGLSLSQESTGIKGPKEFATLRAMAALAAATAATAVADPTKTTQGDLIIPSNFFEPDEEQTKSIQLDRPARELLIWSILVGKLRMAELFWTMEKEPIAAALLASILLTSLGNKTDDFTDKEDYRSFAKNFQERAEGVLNECYREDEHRTQLIINHELIYYGRSSVIKLAAEGQSIKFMAHPCCQDFLTNTWSGNLSTKNSVFRYIMGVVCGLTLPFLIPKVILSKPKTNPTTEGEESSPTSEQQGSTQSNHTMKYVLTAEDAGKKGVRKTLQARTVEYISQIRDFYMAPVVRFVYNTISYITFLILFSYLLLVDFRINITVVEYIVIAWVITLFIEEIKQIAWAVLSGISFRTYISDGWNKLDCAGLALYIIGFILRLIVLLRLGQENNFNIKYERYYIVTDPILDPSRICLAISLFTFYIRLMYTFSFHIALGPKLIMIGKMVTNDLIPFMIILTVIMVGYAVAAQSIAYPNGLFTKENMTLNSEIKHMTFADIIFSMYTTAYFQMFGDFSLDALQGEDRTCQNHMCPTKTSRWLVPIMLGFYVLLTNILMFNLLIAMFSKTYEEIESASTYYWNYQRYQMINDYVHRSPLAPPIIIVWHFYEAYKAIGNQCASLRNAETAKYNPFCVRFTDVKKEREMVKWEHMKAMDYLREPSTKATGKRGVAESRAVVFRGGGGVGPGQGPVMDLKSEMSSVTEGIGMELEKRFKEIDNQFQRFNDVDSRLNDVTQLLTNLSEVISNVTETQQRIIRQINELPTCQCNEFTDEVVPVQKSTTHQTDSGTAETRKRTKLEVAIQSALEAAKDVLRPPTPPPPPPPPPPPQGKESPVLLAAVVPGSEDDSSGSEEGGDPSADPVLVPQVPDIKTGRVIERTLGDHRLWRMAPFNFEKYPGMRMNVPPERMAWTVEYPDYFAYDACEEILLFPSEESHDGVNFTHGNIVFTFQHSENLRTINFNQYDAKAKLRRQSLLGRYRLDSTTGAPLNPMGRTGLLGKGLLPRWGPNHSFVLCITRWTRDTRTGAQIIRSNRGVLQYLALERNKRLCMPWYLTDHTSKCDFDECVLKIISSLITRRGHAMLPEKRVDRLLKRIEKAEVTQIFKGYLDDQLNADSAWMETVVINLHESESKGAQLPDDILKLLNEPNTEEQSKWIEVSHSSNLRTSHNYILKNVAELRRAFY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.1	Very low	27.1	Very low	243 Å²	243	146 Å²	146	100%	1.197	73%	0.729	S	S	*	*				0	99.7	0	-65.3	176.6	177.5	0	0	105.4
2	T	28.9	Very low	26.8	Very low	135 Å²	135	142.6 Å²	142.6	83%	0.828	72%	0.722	S	S	*	*			cis	-168.2	130.4	31.9	21.3	0	0	0	0	103.9
3	E	30.4	Very low	26.6	Very low	163 Å²	163	141.7 Å²	141.7	76%	0.762	72%	0.719	S	S	*	*			cis	-142.9	129	-0.7	-81	175.8	136.6	0	0	106.7	I5	E3-I5 HydrophobicContact CB-CG1 4.3Å
4	Q	34	Very low	26.6	Very low	201 Å²	201	144.1 Å²	144.1	94%	0.939	72%	0.723	S	S	*	*			trans	-85.8	132.3	155.5	-82.5	173.7	-42.9	0	0	106.6
5	I	24.6	Very low	26.4	Very low	119 Å²	119	147.5 Å²	147.5	61%	0.61	74%	0.735	S	S	*	*			trans	-135.6	120.7	171.6	-57.2	179.9	0	0	0	106.5	E3 F7	E3-I5 HydrophobicContact CB-CG1 4.3Å; I5-F7 HydrophobicContact CG2-CD2 4.41Å; I5-F7 HydrophobicContact CG2-CE2 4.47Å
6	P	26.1	Very low	26.2	Very low	91 Å²	91	151.1 Å²	151.1	59%	0.591	74%	0.737	S	S	*	*			trans	-93.1	120.3	-171.7	34.7	-33.6	0	0	0	112.7	Q8	P6-Q8 HydrophobicContact CB-CB 4.18Å
7	F	25.5	Very low	26	Very low	201 Å²	201	150.7 Å²	150.7	88%	0.882	74%	0.737	S	S	*	*			trans	-132.9	49.1	161.9	-86	-83.3	0	0	0	108.9	I5	I5-F7 HydrophobicContact CG2-CD2 4.41Å; I5-F7 HydrophobicContact CG2-CE2 4.47Å
8	Q	25	Very low	25.8	Very low	129 Å²	129	147.8 Å²	147.8	60%	0.603	74%	0.735	S	S	*	*				60.9	122.2	77.7	-171.5	167.9	-37.7	0	0	113.3	P6 T10	P6-Q8 HydrophobicContact CB-CB 4.18Å; Q8-T10 HydrophobicContact CG-CG2 4.11Å; Q8-T10 WeakPolarHBondContact CG-OG1 3.43Å; Q8-T10 PolarHBondContact NE2-OG1 3.43Å
9	R	23.7	Very low	25.6	Very low	180 Å²	180	151.9 Å²	151.9	68%	0.679	74%	0.741	S	S	*	*			trans	-106.4	5.6	-170.4	-96	170.5	-177.1	123.5	-0.5	115.1	E81 T244	R9-E81 IonicContact CZ-OE1 3.56Å; R9-E81 IonicContact NH1-OE1 2.61Å; R9-E81 PolarHBondContact NH1-OE1 2.86Å; R9-E81 IonicContact NH2-OE1 2.79Å; R9-E81 PolarHBondContact NH2-OE1 3.16Å; R9-T244 HydrophobicContact CB-CG2 4.46Å
10	T	24.9	Very low	25.5	Very low	89 Å²	89	151.1 Å²	151.1	55%	0.546	75%	0.745	S	S	.	*			trans	-65.3	128.1	178.5	52.1	0	0	0	0	111.2	Q8	Q8-T10 HydrophobicContact CG-CG2 4.11Å; Q8-T10 WeakPolarHBondContact CG-OG1 3.43Å; Q8-T10 PolarHBondContact NE2-OG1 3.43Å
11	S	24.5	Very low	25.5	Very low	55 Å²	55	147.3 Å²	147.3	39%	0.385	75%	0.745	S	S	.	*			cis	71.3	145.3	16.5	109.9	0	0	0	0	116.2	D246	S11-D246 VanDerWaalsContact CB-CG 3.47Å; S11-D246 WeakPolarHBondContact CB-OD1 3.14Å; S11-D246 WeakPolarHBondContact CB-OD2 3.08Å; S11-D246 PolarHBondContact OG-OD1 2.7Å; S11-D246 PolarHBondContact OG-OD2 2.66Å
12	T	23.6	Very low	25.3	Very low	105 Å²	105	141 Å²	141	64%	0.644	73%	0.725	S	S	*	*			trans	61.1	137	-167.7	81.4	0	0	0	0	113.9
13	L	24	Very low	25.3	Very low	131 Å²	131	140.3 Å²	140.3	69%	0.686	72%	0.72	S	S	*	*			cis	-174.3	131.1	27.3	-124.9	150.3	0	0	0	106.8
14	K	27.8	Very low	25.2	Very low	176 Å²	176	135.6 Å²	135.6	77%	0.765	72%	0.715	S	S	*	*			trans	33.8	120.8	144.9	-66.5	173.8	-168.5	166.2	0	118.9
15	H	23.2	Very low	24.9	Very low	195 Å²	195	133.2 Å²	133.2	90%	0.903	70%	0.704	S	S	*	*			trans	-109.7	89.6	134.8	-123.4	-61.5	0	0	0	109.5
16	R	23.4	Very low	25.1	Very low	204 Å²	204	132.8 Å²	132.8	77%	0.77	70%	0.703	S	S	*	*			trans	-73	157.1	150.7	-156.4	-172.4	-165.7	176.9	5.3	107
17	I	22.7	Very low	25.3	Very low	145 Å²	145	133.3 Å²	133.3	74%	0.744	70%	0.701	S	S	*	*			trans	97	112.1	154.5	-51.9	160.4	0	0	0	116.1
18	S	21.6	Very low	25.5	Very low	99 Å²	99	128.8 Å²	128.8	69%	0.692	69%	0.686	S	S	*	*			trans	-52.1	148	161	-21.4	0	0	0	0	112.9
19	R	22.7	Very low	25.9	Very low	226 Å²	226	129.3 Å²	129.3	85%	0.853	69%	0.693	S	S	*	*			trans	75	121.9	156.1	-66.1	179.1	175.1	176.8	-1.3	118.9
20	T	23.6	Very low	26.1	Very low	134 Å²	134	126.2 Å²	126.2	82%	0.822	69%	0.69	S	S	*	*			trans	62.7	118.1	138	59.4	0	0	0	0	120.1
21	G	25.9	Very low	26.2	Very low	73 Å²	73	130.3 Å²	130.3	75%	0.753	71%	0.707	S	S	*	*				103.8	108	124.4	0	0	0	0	0	117.6
22	S	26.1	Very low	26.2	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	72%	0.724	S	S	*	*				78.8	118.1	123.4	-156.9	0	0	0	0	118.4
23	V	27.2	Very low	26.3	Very low	121 Å²	121	131.9 Å²	131.9	73%	0.733	73%	0.728	S	S	*	*			trans	67	108.8	138.2	178.7	0	0	0	0	113.7
24	G	28.5	Very low	26.3	Very low	64 Å²	64	130.9 Å²	130.9	66%	0.66	73%	0.732	S	S	*	*			cis	127.2	166.6	35	0	0	0	0	0	107.2
25	Q	28.8	Very low	26.2	Very low	152 Å²	152	130.1 Å²	130.1	71%	0.71	74%	0.735	S	S	*	*			trans	69.1	104.3	150.4	-67.3	-164	-71.5	0	0	114.5
26	D	28.5	Very low	26.2	Very low	109 Å²	109	127 Å²	127	58%	0.583	73%	0.725	S	S	*	*				98.1	140.7	86.2	-79	-6.5	0	0	0	106.7
27	N	30.6	Very low	26.2	Very low	103 Å²	103	124 Å²	124	55%	0.551	72%	0.723	S	S	*	*			cis	-178.9	148.5	9.8	-111.4	-21.3	0	0	0	107.5
28	N	29	Very low	26.2	Very low	105 Å²	105	121.8 Å²	121.8	56%	0.561	72%	0.72	S	S	*	*				65.6	125.8	129.7	-53.8	-21	0	0	0	119.7
29	N	32.7	Very low	26.4	Very low	140 Å²	140	122.2 Å²	122.2	75%	0.749	72%	0.723	S	S	*	*				-179	110.1	95.2	-84.3	-39.7	0	0	0	109
30	N	29.9	Very low	26.6	Very low	116 Å²	116	114.8 Å²	114.8	62%	0.62	72%	0.717	S	S	*	*				61	90.2	89	-73	-28.6	0	0	0	113.5
31	I	26	Very low	26.7	Very low	174 Å²	174	115.5 Å²	115.5	89%	0.892	71%	0.714	S	S	*	*			trans	-122.7	85.9	137.4	-60.3	-179.2	0	0	0	107.1
32	T	25.1	Very low	26.8	Very low	122 Å²	122	117.5 Å²	117.5	75%	0.748	71%	0.707	S	S	*	*			trans	-62.9	134.6	155.1	44.9	0	0	0	0	109.8
33	G	25.7	Very low	26.8	Very low	71 Å²	71	118.6 Å²	118.6	73%	0.732	71%	0.71	S	S	*	*			trans	-165.6	75.1	176.7	0	0	0	0	0	112.8
34	S	24.5	Very low	26.8	Very low	111 Å²	111	116.1 Å²	116.1	78%	0.776	71%	0.709	S	S	*	*			trans	-53.3	138.2	154.5	48.8	0	0	0	0	111.7
35	I	24.4	Very low	26.7	Very low	159 Å²	159	120.9 Å²	120.9	82%	0.815	72%	0.717	S	S	*	*			trans	178.5	104.5	151.4	-87.8	144.2	0	0	0	106
36	N	23.4	Very low	26.7	Very low	131 Å²	131	121.5 Å²	121.5	70%	0.701	72%	0.72	S	S	*	*				67.5	113.4	95.1	-89.1	-9.7	0	0	0	116.4
37	I	23.6	Very low	26.8	Very low	140 Å²	140	124.7 Å²	124.7	72%	0.718	73%	0.731	S	S	*	*				58.4	116.7	120.6	-56.1	168.3	0	0	0	118.3
38	S	23.3	Very low	26.6	Very low	99 Å²	99	124 Å²	124	69%	0.692	73%	0.725	S	S	*	*			trans	89.2	131.4	140.8	70.4	0	0	0	0	122.4
39	S	25.2	Very low	26.6	Very low	107 Å²	107	121.7 Å²	121.7	75%	0.748	72%	0.717	S	S	*	*			trans	63	113.1	137.6	64.3	0	0	0	0	121.1
40	G	26.3	Very low	26.5	Very low	70 Å²	70	119.4 Å²	119.4	72%	0.722	71%	0.712	S	S	*	*				74.4	150.6	127.2	0	0	0	0	0	119.7
41	I	26.7	Very low	26.6	Very low	149 Å²	149	119.5 Å²	119.5	76%	0.764	71%	0.712	S	S	*	*			trans	93	137.8	164.7	-48.3	161.8	0	0	0	115.7	T43	I41-T43 PolarHBondContact O-N 3.26Å
42	N	27.2	Very low	26.8	Very low	115 Å²	115	119.3 Å²	119.3	62%	0.615	70%	0.7	S	S	*	*			trans	6.2	91.9	165.2	-56	2	0	0	0	115.1
43	T	26.6	Very low	27.1	Very low	132 Å²	132	122 Å²	122	81%	0.81	70%	0.696	S	S	*	*			cis	54.1	87.3	22.5	72	0	0	0	0	114.2	I41	I41-T43 PolarHBondContact O-N 3.26Å
44	G	27.5	Very low	27.4	Very low	69 Å²	69	123.3 Å²	123.3	71%	0.711	70%	0.7	S	S	*	*			trans	-175.6	-168.1	177.9	0	0	0	0	0	113
45	I	25.9	Very low	27.9	Very low	164 Å²	164	122.1 Å²	122.1	84%	0.841	69%	0.691	S	S	*	*			trans	50.7	64.2	170	-45	176.3	0	0	0	114
46	Q	28.4	Very low	28.6	Very low	166 Å²	166	118.9 Å²	118.9	78%	0.776	68%	0.679	S	S	*	*			trans	-161.5	42.3	144.8	-114.6	173	13.1	0	0	112.5	Q48	Q46-Q48 PolarHBondContact O-N 3.43Å
47	Q	31.8	Very low	29.5	Very low	175 Å²	175	115.8 Å²	115.8	82%	0.818	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	45.6	158.9	-151.8	172.8	22.6	0	0	110.1	I51	Q47-I51 WeakPolarHBondContact O-CD1 3.41Å
48	Q	26.8	Very low	30.5	Very low	88 Å²	88	117 Å²	117	41%	0.411	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.8	-9.9	178.7	-66.7	-170.1	7	0	0	113.7	Q46 S50 I51 R52	Q46-Q48 PolarHBondContact O-N 3.43Å; Q48-S50 PolarHBondContact O-N 3.02Å; Q48-I51 PolarHBondContact O-N 3.25Å; Q48-R52 HydrophobicContact CB-CG 4.5Å; Q48-R52 PolarHBondContact O-N 3.1Å; Q48-R52 VanDerWaalsContact OE1-CZ 3.31Å
49	S	28.5	Very low	32.2	Very low	57 Å²	57	118.7 Å²	118.7	40%	0.399	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.8	-29.3	177.3	50.9	0	0	0	0	112.8	R53	S49-R53 VanDerWaalsContact O-CD 3.31Å; S49-R53 WeakPolarHBondContact O-CD 3.2Å; S49-R53 WeakPolarHBondContact O-CG 3.39Å; S49-R53 VanDerWaalsContact O-CZ 3.22Å; S49-R53 PolarHBondContact O-NE 2.9Å; S49-R53 VanDerWaalsContact O-NE 3.12Å; S49-R53 PolarHBondContact O-NH1 3.49Å
50	S	30.7	Very low	34	Very low	93 Å²	93	118.8 Å²	118.8	65%	0.65	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	2.9	172.5	43	0	0	0	0	114.1	Q48	Q48-S50 PolarHBondContact O-N 3.02Å
51	I	32.1	Very low	36.4	Very low	118 Å²	118	118.2 Å²	118.2	61%	0.605	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	-51.3	178.9	-54.1	-179.8	0	0	0	111	Q47 Q48 R53	Q47-I51 WeakPolarHBondContact O-CD1 3.41Å; Q48-I51 PolarHBondContact O-N 3.25Å; I51-R53 PolarHBondContact O-N 3.4Å
52	R	28.5	Very low	39.1	Very low	169 Å²	169	111.3 Å²	111.3	64%	0.638	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-67.5	-10.3	-173.8	-68.2	-179.4	178.9	-103.3	0.3	114.8	Q48 A54 S55	Q48-R52 HydrophobicContact CB-CG 4.5Å; Q48-R52 PolarHBondContact O-N 3.1Å; Q48-R52 VanDerWaalsContact OE1-CZ 3.31Å; R52-A54 PolarHBondContact O-N 3.39Å; R52-A54 VanDerWaalsContact O-N 3.13Å; R52-S55 PolarHBondContact O-N 2.65Å; R52-S55 VanDerWaalsContact O-N 3.15Å; R52-S55 PolarHBondContact O-OG 3.15Å
53	R	33.1	Very low	41.9	Very low	180 Å²	180	109.5 Å²	109.5	68%	0.679	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-66	-14.7	-174.2	-79.8	177.3	-175.9	143.9	2.9	114.7	S49 I51 S55	S49-R53 VanDerWaalsContact O-CD 3.31Å; S49-R53 WeakPolarHBondContact O-CD 3.2Å; S49-R53 WeakPolarHBondContact O-CG 3.39Å; S49-R53 VanDerWaalsContact O-CZ 3.22Å; S49-R53 PolarHBondContact O-NE 2.9Å; S49-R53 VanDerWaalsContact O-NE 3.12Å; S49-R53 PolarHBondContact O-NH1 3.49Å; I51-R53 PolarHBondContact O-N 3.4Å; R53-S55 VanDerWaalsContact C-N 3.27Å; R53-S55 PolarHBondContact O-N 2.95Å
54	A	31.1	Very low	44.8	Very low	98 Å²	98	103.2 Å²	103.2	81%	0.81	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-71.3	-15.9	173.5	0	0	0	0	0	114	R52	R52-A54 PolarHBondContact O-N 3.39Å; R52-A54 VanDerWaalsContact O-N 3.13Å
55	S	35.8	Very low	47.5	Very low	85 Å²	85	104.4 Å²	104.4	59%	0.594	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-103	1.1	-173.7	82	0	0	0	0	115.8	R52 R53	R52-S55 PolarHBondContact O-N 2.65Å; R52-S55 VanDerWaalsContact O-N 3.15Å; R52-S55 PolarHBondContact O-OG 3.15Å; R53-S55 VanDerWaalsContact C-N 3.27Å; R53-S55 PolarHBondContact O-N 2.95Å
56	V	38	Very low	50.3	Low	92 Å²	92	96.6 Å²	96.6	56%	0.558	49%	0.485	S	S	*	.	S	Bend	trans	-98.1	-14.5	-177.4	-177.8	0	0	0	0	112.6	Q58	V56-Q58 VanDerWaalsContact C-N 3.27Å; V56-Q58 PolarHBondContact O-N 3.34Å
57	M	41.9	Very low	52.4	Low	66 Å²	66	91.1 Å²	91.1	33%	0.325	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-73.2	-9.7	-178.4	-81.3	-98	102.7	0	0	114.9	K59 Y60 I86	M57-K59 PolarHBondContact O-N 3.09Å; M57-Y60 HydrophobicContact CE-CD2 4.32Å; M57-I86 HydrophobicContact CE-CD1 3.93Å; M57-I86 HydrophobicContact CE-CG1 4.24Å; M57-I86 HydrophobicContact CE-CG2 3.51Å; M57-I86 HydrophobicContact SD-CG2 3.91Å
58	Q	45.8	Very low	54	Low	166 Å²	166	86 Å²	86	78%	0.776	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-68.5	-10.9	175.6	-93.2	177	-37.2	0	0	113.4	V56 Y60	V56-Q58 VanDerWaalsContact C-N 3.27Å; V56-Q58 PolarHBondContact O-N 3.34Å; Q58-Y60 PolarHBondContact O-N 3.48Å
59	K	57.6	Low	55.8	Low	134 Å²	134	85.8 Å²	85.8	58%	0.583	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-88.3	6.4	-171.2	-139.3	-176.3	-179.9	-169.3	0	115.7	M57	M57-K59 PolarHBondContact O-N 3.09Å
60	Y	64.5	Low	57.5	Low	108 Å²	108	88.2 Å²	88.2	42%	0.424	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-135.6	10.4	-164.9	-60.6	-76	0	0	0	115.5	M57 Q58 C76 K77	M57-Y60 HydrophobicContact CE-CD2 4.32Å; Q58-Y60 PolarHBondContact O-N 3.48Å; Y60-C76 CarbonylContact O-C 3.57Å; Y60-C76 WeakPolarHBondContact O-CA 3.45Å; Y60-C76 WeakPolarHBondContact O-CB 3.43Å; Y60-K77 WeakPolarHBondContact CD1-O 3.05Å; Y60-K77 PolarHBondContact O-N 3.09Å
61	M	76.4	Confident	59.4	Low	58 Å²	58	86.9 Å²	86.9	29%	0.286	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	142	-175.4	-176.1	175.1	162.6	0	0	111	F75 K94 W95	M61-F75 WeakPolarHBondContact CA-O 3.47Å; M61-K94 HydrophobicContact SD-CB 4.13Å; M61-W95 VanDerWaalsContact CE-CD1 3.42Å; M61-W95 VanDerWaalsContact CE-NE1 3.28Å
62	G	82.3	Confident	61.8	Low	4 Å²	4	86.4 Å²	86.4	4%	0.041	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	178.7	173.1	0	0	0	0	0	111.6	F75 G188	G62-F75 VanDerWaalsContact CA-CE1 3.42Å; G62-F75 PolarHBondContact N-O 3.35Å; G62-F75 WeakPolarHBondContact O-CD1 3.44Å; G62-F75 PolarHBondContact O-N 2.8Å; G62-F75 VanDerWaalsContact O-O 3.11Å; G62-G188 WeakPolarHBondContact CA-O 3.2Å
63	E	86.3	Confident	64.5	Low	77 Å²	77	78.4 Å²	78.4	36%	0.36	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.6	173.7	-57.1	-166.7	146.1	0	0	109.8	A73 R74 G188 T189 A190	E63-A73 CarbonylContact C-O 3.52Å; E63-A73 WeakPolarHBondContact CA-O 3.5Å; E63-R74 HydrophobicContact CG-CG 4.21Å; E63-R74 IonicContact OE1-CZ 3.13Å; E63-R74 IonicContact OE1-NE 2.91Å; E63-R74 PolarHBondContact OE1-NE 3.16Å; E63-R74 IonicContact OE1-NH2 3.36Å; E63-G188 PolarHBondContact N-O 2.84Å; E63-T189 CarbonylContact O-C 3.52Å; E63-T189 WeakPolarHBondContact O-CA 3.37Å; E63-A190 PolarHBondContact O-N 3.43Å
64	I	87.2	Confident	67.2	Low	1 Å²	1	74.1 Å²	74.1	1%	0.005	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.9	176.5	-49.3	-177.4	0	0	0	107.5	F66 T72 A73 F75 L181 A190 Y192 L230 F237	I64-F66 HydrophobicContact CB-CE2 4.41Å; I64-F66 HydrophobicContact CG2-CD1 4.48Å; I64-F66 HydrophobicContact CG2-CD2 4.23Å; I64-F66 HydrophobicContact CG2-CE1 4.27Å; I64-F66 HydrophobicContact CG2-CE2 4Å; I64-F66 HydrophobicContact CG2-CG 4.47Å; I64-F66 HydrophobicContact CG2-CZ 4.02Å; I64-T72 WeakPolarHBondContact O-CA 3.22Å; I64-A73 HydrophobicContact CB-CB 4.49Å; I64-A73 PolarHBondContact N-O 3.32Å; I64-A73 PolarHBondContact O-N 3Å; I64-F75 HydrophobicContact CD1-CB 4.02Å; I64-F75 HydrophobicContact CD1-CD1 3.94Å; I64-F75 HydrophobicContact CD1-CG 4.08Å; I64-F75 HydrophobicContact CG1-CB 4.24Å; I64-F75 HydrophobicContact CG1-CD1 3.35Å; I64-F75 HydrophobicContact CG1-CE1 3.88Å; I64-F75 HydrophobicContact CG1-CG 4.01Å; I64-L181 HydrophobicContact CD1-CD2 3.69Å; I64-L181 HydrophobicContact CG1-CD2 3.83Å; I64-A190 CarbonylContact C-O 3.55Å; I64-A190 WeakPolarHBondContact CA-O 3.49Å; I64-Y192 VanDerWaalsContact CG2-CB 3.45Å; I64-Y192 HydrophobicContact CG2-CG 4.23Å; I64-L230 HydrophobicContact CD1-CD1 3.85Å; I64-F237 HydrophobicContact CD1-CD2 3.98Å; I64-F237 HydrophobicContact CD1-CE2 4.39Å
65	E	85.5	Confident	70	Confident	94 Å²	94	69.4 Å²	69.4	44%	0.439	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	111.4	168.1	-172.2	175.4	-176	0	0	107.8	A190 V191 Y192	E65-A190 PolarHBondContact N-O 3.44Å; E65-V191 WeakPolarHBondContact O-CA 3.38Å; E65-Y192 PolarHBondContact O-N 3.16Å
66	F	84.2	Confident	72.6	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	122.5	178.4	-70	-84.5	0	0	0	109.8	I64 N70 Q71 A73 Y192 L230 P232 F237	I64-F66 HydrophobicContact CB-CE2 4.41Å; I64-F66 HydrophobicContact CG2-CD1 4.48Å; I64-F66 HydrophobicContact CG2-CD2 4.23Å; I64-F66 HydrophobicContact CG2-CE1 4.27Å; I64-F66 HydrophobicContact CG2-CE2 4Å; I64-F66 HydrophobicContact CG2-CG 4.47Å; I64-F66 HydrophobicContact CG2-CZ 4.02Å; F66-N70 VanDerWaalsContact O-CA 3.31Å; F66-N70 WeakPolarHBondContact O-CA 3.34Å; F66-N70 PolarHBondContact O-N 3.14Å; F66-Q71 PolarHBondContact N-O 3.35Å; F66-A73 HydrophobicContact CE2-CB 3.83Å; F66-Y192 WeakPolarHBondContact CA-O 3.31Å; F66-Y192 AromaticContact CD1-CD1 3.85Å; F66-Y192 HydrophobicContact CD1-CD1 3.85Å; F66-Y192 AromaticContact CE1-CD1 3.59Å; F66-Y192 HydrophobicContact CE1-CD1 3.59Å; F66-Y192 HydrophobicContact CE1-CE1 4.14Å; F66-Y192 HydrophobicContact CE1-CG 4.5Å; F66-L230 HydrophobicContact CE1-CB 4.26Å; F66-L230 HydrophobicContact CZ-CB 4.29Å; F66-P232 HydrophobicContact CB-CB 4.11Å; F66-P232 HydrophobicContact CD1-CB 3.83Å; F66-P232 HydrophobicContact CD2-CB 4.19Å; F66-P232 HydrophobicContact CE1-CB 4.26Å; F66-P232 HydrophobicContact CG-CB 3.79Å; F66-F237 AromaticContact CE2-CE2 3.94Å; F66-F237 HydrophobicContact CE2-CE2 3.94Å; F66-F237 HydrophobicContact CE2-CZ 4.46Å; F66-F237 AromaticContact CZ-CE2 3.76Å; F66-F237 HydrophobicContact CZ-CE2 3.76Å; F66-F237 AromaticContact CZ-CZ 3.95Å; F66-F237 HydrophobicContact CZ-CZ 3.95Å
67	T	72.1	Confident	74.9	Confident	51 Å²	51	62.5 Å²	62.5	31%	0.313	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	143.6	-178.7	51.7	0	0	0	0	112.6	L69 V191 Y192 Q193	T67-L69 PolarHBondContact O-N 2.91Å; T67-V191 HydrophobicContact CG2-CG1 3.19Å; T67-Y192 PolarHBondContact N-O 3.04Å; T67-Y192 VanDerWaalsContact N-O 3.16Å; T67-Q193 HydrophobicContact CG2-CG 3.89Å; T67-Q193 WeakPolarHBondContact OG1-CG 3.38Å
68	G	65.3	Low	77	Confident	66 Å²	66	59.7 Å²	59.7	68%	0.68	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-42.4	175.2	0	0	0	0	0	113.5	N70	G68-N70 PolarHBondContact N-OD1 2.96Å; G68-N70 PolarHBondContact O-ND2 3.07Å
69	L	64	Low	78.6	Confident	85 Å²	85	55.5 Å²	55.5	45%	0.445	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-26.1	172.4	-66.7	171.9	0	0	0	112.9	T67 Q71 P232	T67-L69 PolarHBondContact O-N 2.91Å; L69-Q71 PolarHBondContact O-N 3.08Å; L69-Q71 VanDerWaalsContact O-N 3.07Å; L69-P232 HydrophobicContact CD1-CB 3.56Å; L69-P232 HydrophobicContact CD1-CG 3.42Å; L69-P232 VanDerWaalsContact CD1-CG 3.42Å
70	N	64	Low	79.4	Confident	108 Å²	108	50.2 Å²	50.2	58%	0.578	27%	0.268	S	S	*	.			trans	59.6	20.3	168.4	-26.8	-72.3	0	0	0	114.8	F66 G68	F66-N70 VanDerWaalsContact O-CA 3.31Å; F66-N70 WeakPolarHBondContact O-CA 3.34Å; F66-N70 PolarHBondContact O-N 3.14Å; G68-N70 PolarHBondContact N-OD1 2.96Å; G68-N70 PolarHBondContact O-ND2 3.07Å
71	Q	71.6	Confident	79.9	Confident	65 Å²	65	50.5 Å²	50.5	30%	0.304	27%	0.274	S	S	.	.			trans	-77.9	145.4	167.6	-63.4	-175.1	6.8	0	0	109.5	F66 L69 P232	F66-Q71 PolarHBondContact N-O 3.35Å; L69-Q71 PolarHBondContact O-N 3.08Å; L69-Q71 VanDerWaalsContact O-N 3.07Å; Q71-P232 PolarHBondContact OE1-O 3.4Å; Q71-P232 VanDerWaalsContact OE1-O 3.06Å
72	T	81.6	Confident	80	Confident	107 Å²	107	48.6 Å²	48.6	66%	0.656	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.9	175.9	53.6	0	0	0	0	110.1	I64	I64-T72 WeakPolarHBondContact O-CA 3.22Å
73	A	86.5	Confident	79.9	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.017	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.7	175.8	0	0	0	0	0	110.4	E63 I64 F66 H234 N235 F237	E63-A73 CarbonylContact C-O 3.52Å; E63-A73 WeakPolarHBondContact CA-O 3.5Å; I64-A73 HydrophobicContact CB-CB 4.49Å; I64-A73 PolarHBondContact N-O 3.32Å; I64-A73 PolarHBondContact O-N 3Å; F66-A73 HydrophobicContact CE2-CB 3.83Å; A73-H234 WeakPolarHBondContact CB-O 3.41Å; A73-N235 WeakPolarHBondContact CA-O 3.32Å; A73-F237 HydrophobicContact CB-CD2 3.87Å; A73-F237 HydrophobicContact CB-CE2 3.65Å
74	R	89.3	Confident	79.6	Confident	89 Å²	89	50 Å²	50	34%	0.336	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	134.6	176.2	-68.3	-177.2	169.8	156.2	3.3	110	E63 W95 N235 F236 F237	E63-R74 HydrophobicContact CG-CG 4.21Å; E63-R74 IonicContact OE1-CZ 3.13Å; E63-R74 IonicContact OE1-NE 2.91Å; E63-R74 PolarHBondContact OE1-NE 3.16Å; E63-R74 IonicContact OE1-NH2 3.36Å; R74-W95 PolarHBondContact NH1-O 2.92Å; R74-N235 PolarHBondContact N-O 2.88Å; R74-F236 HydrophobicContact CB-CD1 3.95Å; R74-F236 HydrophobicContact CB-CE1 4.22Å; R74-F236 CarbonylContact O-C 3.56Å; R74-F236 VanDerWaalsContact O-CA 3.29Å; R74-F236 WeakPolarHBondContact O-CA 3.03Å; R74-F237 PolarHBondContact O-N 3.35Å
75	F	90.5	Very high	79.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	152	178	80.2	-79	0	0	0	112.7	M61 G62 I64 L181 A184 L185 F237 L239	M61-F75 WeakPolarHBondContact CA-O 3.47Å; G62-F75 VanDerWaalsContact CA-CE1 3.42Å; G62-F75 PolarHBondContact N-O 3.35Å; G62-F75 WeakPolarHBondContact O-CD1 3.44Å; G62-F75 PolarHBondContact O-N 2.8Å; G62-F75 VanDerWaalsContact O-O 3.11Å; I64-F75 HydrophobicContact CD1-CB 4.02Å; I64-F75 HydrophobicContact CD1-CD1 3.94Å; I64-F75 HydrophobicContact CD1-CG 4.08Å; I64-F75 HydrophobicContact CG1-CB 4.24Å; I64-F75 HydrophobicContact CG1-CD1 3.35Å; I64-F75 HydrophobicContact CG1-CE1 3.88Å; I64-F75 HydrophobicContact CG1-CG 4.01Å; F75-L181 HydrophobicContact CE1-CD2 4.43Å; F75-L181 HydrophobicContact CE2-CB 4.18Å; F75-L181 HydrophobicContact CZ-CB 4.22Å; F75-L181 HydrophobicContact CZ-CD2 4.4Å; F75-L181 WeakPolarHBondContact CZ-O 3.47Å; F75-A184 HydrophobicContact CE1-CB 4.08Å; F75-A184 HydrophobicContact CZ-CB 3.94Å; F75-L185 HydrophobicContact CE2-CD2 3.75Å; F75-L185 HydrophobicContact CE2-CG 4.01Å; F75-L185 HydrophobicContact CZ-CD2 4.13Å; F75-L185 HydrophobicContact CZ-CG 4.21Å; F75-F237 CarbonylContact C-O 3.56Å; F75-F237 VanDerWaalsContact CA-O 3.25Å; F75-F237 WeakPolarHBondContact CA-O 3.32Å; F75-F237 HydrophobicContact CB-CB 3.74Å; F75-L239 HydrophobicContact CD2-CD1 3.73Å; F75-L239 HydrophobicContact CE2-CD1 4.4Å; F75-L239 HydrophobicContact CG-CD1 4.48Å
76	C	89	Confident	79	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.2	169	64.6	0	0	0	0	110.7	Y60 W95 F237 L239	Y60-C76 CarbonylContact O-C 3.57Å; Y60-C76 WeakPolarHBondContact O-CA 3.45Å; Y60-C76 WeakPolarHBondContact O-CB 3.43Å; C76-W95 HydrophobicContact CB-CZ2 4.25Å; C76-F237 PolarHBondContact N-O 3.02Å; C76-L239 PolarHBondContact O-N 2.86Å
77	K	87.6	Confident	78.9	Confident	29 Å²	29	50.8 Å²	50.8	13%	0.126	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	115.5	175.5	-176.6	175.2	178	174.9	0	108.7	Y60 W172 L185 L239 D241	Y60-K77 WeakPolarHBondContact CD1-O 3.05Å; Y60-K77 PolarHBondContact O-N 3.09Å; K77-W172 HydrophobicContact CD-CD2 4.06Å; K77-W172 HydrophobicContact CD-CE3 4.04Å; K77-W172 HydrophobicContact CD-CH2 4.3Å; K77-W172 HydrophobicContact CD-CZ2 4.33Å; K77-W172 HydrophobicContact CD-CZ3 4.16Å; K77-W172 HydrophobicContact CG-CE3 4.27Å; K77-L185 HydrophobicContact CB-CD1 3.94Å; K77-L185 HydrophobicContact CB-CD2 4.18Å; K77-L185 HydrophobicContact CD-CD1 3.64Å; K77-L185 HydrophobicContact CG-CD1 4.4Å; K77-L239 WeakPolarHBondContact CA-O 3.33Å; K77-D241 WeakPolarHBondContact CE-OD2 3.36Å; K77-D241 HydrophobicContact CG-CB 4.46Å; K77-D241 IonicContact NZ-OD2 2.69Å; K77-D241 PolarHBondContact NZ-OD2 3.22Å
78	L	85.6	Confident	79.3	Confident	7 Å²	7	53.2 Å²	53.2	4%	0.037	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	147.8	-176.1	-56.9	-177.4	0	0	0	110.7	T82 L87 I90 V238 L239 V240 D241 L255	L78-T82 HydrophobicContact CD2-CG2 4.4Å; L78-L87 HydrophobicContact CD1-CD2 3.28Å; L78-I90 HydrophobicContact CD2-CD1 3.87Å; L78-V238 HydrophobicContact CD1-CG1 3.7Å; L78-V238 HydrophobicContact CG-CG1 4.38Å; L78-L239 PolarHBondContact N-O 3.04Å; L78-V240 CarbonylContact O-C 3.59Å; L78-V240 WeakPolarHBondContact O-CA 3.39Å; L78-D241 PolarHBondContact O-N 3Å; L78-L255 HydrophobicContact CB-CD1 4.31Å
79	N	80.1	Confident	80	Confident	79 Å²	79	52.8 Å²	52.8	42%	0.422	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	147.2	169.3	-174.6	-18.8	0	0	0	109.3	E81 T82 D241 L255	N79-E81 PolarHBondContact O-N 2.87Å; N79-E81 VanDerWaalsContact O-N 3.09Å; N79-E81 PolarHBondContact OD1-N 2.97Å; N79-T82 PolarHBondContact N-OG1 3.38Å; N79-T82 VanDerWaalsContact N-OG1 3.09Å; N79-T82 VanDerWaalsContact O-CB 3.26Å; N79-T82 WeakPolarHBondContact O-CB 3.5Å; N79-T82 PolarHBondContact O-N 3.21Å; N79-T82 PolarHBondContact O-OG1 2.84Å; N79-D241 WeakPolarHBondContact CA-O 3.46Å; N79-D241 PolarHBondContact OD1-O 2.93Å; N79-L255 WeakPolarHBondContact O-CD1 3.47Å
80	S	74.5	Confident	80.9	Confident	22 Å²	22	49.5 Å²	49.5	15%	0.154	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-30.6	172.8	174.8	0	0	0	0	113.3	T82 D242 R258	S80-T82 PolarHBondContact O-N 3.26Å; S80-D242 WeakPolarHBondContact CB-OD1 3.36Å; S80-R258 PolarHBondContact O-NH1 3.31Å
81	E	74.5	Confident	81.9	Confident	115 Å²	115	44.5 Å²	44.5	54%	0.537	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	4.9	177.6	-64.5	-178.3	179.9	0	0	115.3	R9 N79	R9-E81 IonicContact CZ-OE1 3.56Å; R9-E81 IonicContact NH1-OE1 2.61Å; R9-E81 PolarHBondContact NH1-OE1 2.86Å; R9-E81 IonicContact NH2-OE1 2.79Å; R9-E81 PolarHBondContact NH2-OE1 3.16Å; N79-E81 PolarHBondContact O-N 2.87Å; N79-E81 VanDerWaalsContact O-N 3.09Å; N79-E81 PolarHBondContact OD1-N 2.97Å
82	T	78.1	Confident	82.3	Confident	18 Å²	18	48 Å²	48	11%	0.11	25%	0.246	C	C	.	.			trans	-61.8	127	-175.9	-58.1	0	0	0	0	111.6	L78 N79 S80 I86 R258	L78-T82 HydrophobicContact CD2-CG2 4.4Å; N79-T82 PolarHBondContact N-OG1 3.38Å; N79-T82 VanDerWaalsContact N-OG1 3.09Å; N79-T82 VanDerWaalsContact O-CB 3.26Å; N79-T82 WeakPolarHBondContact O-CB 3.5Å; N79-T82 PolarHBondContact O-N 3.21Å; N79-T82 PolarHBondContact O-OG1 2.84Å; S80-T82 PolarHBondContact O-N 3.26Å; T82-I86 HydrophobicContact CG2-CB 3.99Å; T82-I86 HydrophobicContact CG2-CD1 4.2Å; T82-I86 HydrophobicContact CG2-CG2 3.94Å; T82-R258 PolarHBondContact O-NH1 3.28Å; T82-R258 PolarHBondContact O-NH2 2.61Å
83	P	80	Confident	82.2	Confident	64 Å²	64	51.3 Å²	51.3	42%	0.416	25%	0.246	S	C	.	.			trans	-68.4	146.7	-177.4	27.2	-36.3	0	0	0	113.8	S85 I86	P83-S85 PolarHBondContact O-N 2.79Å; P83-I86 HydrophobicContact CG-CD1 3.68Å; P83-I86 HydrophobicContact CG-CG1 4.07Å; P83-I86 PolarHBondContact O-N 2.97Å
84	D	81.2	Confident	81.7	Confident	46 Å²	46	57.2 Å²	57.2	25%	0.246	27%	0.271	C	S	.	.	H	α-helix	trans	-56.8	-24.2	-177.3	-62.5	6.2	0	0	0	114.7	I86 R88 R258	D84-I86 VanDerWaalsContact C-N 3.32Å; D84-R88 PolarHBondContact O-N 3.47Å; D84-R258 IonicContact OD1-CZ 2.73Å; D84-R258 IonicContact OD1-NE 2.85Å; D84-R258 PolarHBondContact OD1-NE 3.06Å; D84-R258 IonicContact OD1-NH2 3.98Å; D84-R258 PolarHBondContact OD1-NH2 3.38Å
85	S	77.8	Confident	81.5	Confident	66 Å²	66	53.4 Å²	53.4	46%	0.462	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-35.9	176.3	51.2	0	0	0	0	112.6	P83 D89	P83-S85 PolarHBondContact O-N 2.79Å; S85-D89 PolarHBondContact O-N 3.49Å; S85-D89 VanDerWaalsContact O-N 3.13Å
86	I	80.8	Confident	81	Confident	41 Å²	41	56.2 Å²	56.2	21%	0.21	29%	0.285	C	S	.	.	H	α-helix	trans	-71.9	-42.9	178.8	-67.8	175.7	0	0	0	110	M57 T82 P83 D84 R88 D89 I90	M57-I86 HydrophobicContact CE-CD1 3.93Å; M57-I86 HydrophobicContact CE-CG1 4.24Å; M57-I86 HydrophobicContact CE-CG2 3.51Å; M57-I86 HydrophobicContact SD-CG2 3.91Å; T82-I86 HydrophobicContact CG2-CB 3.99Å; T82-I86 HydrophobicContact CG2-CD1 4.2Å; T82-I86 HydrophobicContact CG2-CG2 3.94Å; P83-I86 HydrophobicContact CG-CD1 3.68Å; P83-I86 HydrophobicContact CG-CG1 4.07Å; P83-I86 PolarHBondContact O-N 2.97Å; D84-I86 VanDerWaalsContact C-N 3.32Å; I86-R88 VanDerWaalsContact C-N 3.33Å; I86-R88 PolarHBondContact O-N 2.79Å; I86-D89 PolarHBondContact O-N 2.78Å; I86-D89 VanDerWaalsContact O-N 3.13Å; I86-I90 HydrophobicContact CG2-CD1 3.88Å; I86-I90 HydrophobicContact CG2-CG1 4.4Å; I86-I90 WeakPolarHBondContact O-CG1 3.3Å; I86-I90 PolarHBondContact O-N 3.42Å
87	L	82.5	Confident	80.7	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-55	-47.4	174.9	-70.9	174.5	0	0	0	111.7	L78 D89 I90 L91 F259	L78-L87 HydrophobicContact CD1-CD2 3.28Å; L87-D89 VanDerWaalsContact C-N 3.35Å; L87-D89 PolarHBondContact O-N 3.15Å; L87-I90 PolarHBondContact O-N 2.69Å; L87-L91 WeakPolarHBondContact O-CG 3.11Å; L87-L91 PolarHBondContact O-N 3.11Å; L87-L91 VanDerWaalsContact O-N 3.12Å; L87-F259 HydrophobicContact CD2-CD2 4.25Å
88	R	80.5	Confident	80.3	Confident	103 Å²	103	64.2 Å²	64.2	39%	0.389	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-39.2	176.2	-77.4	-172.9	-82.8	-95.5	-2.5	113	D84 I86 K92	D84-R88 PolarHBondContact O-N 3.47Å; I86-R88 VanDerWaalsContact C-N 3.33Å; I86-R88 PolarHBondContact O-N 2.79Å; R88-K92 VanDerWaalsContact O-CB 3.29Å; R88-K92 WeakPolarHBondContact O-CB 3.47Å; R88-K92 PolarHBondContact O-N 3.41Å
89	D	80.6	Confident	79.8	Confident	56 Å²	56	66 Å²	66	30%	0.299	33%	0.333	S	S	.	.	H	α-helix	trans	-68.6	-36.8	179.1	-81.9	2.5	0	0	0	112.1	S85 I86 L87 R93 K94	S85-D89 PolarHBondContact O-N 3.49Å; S85-D89 VanDerWaalsContact O-N 3.13Å; I86-D89 PolarHBondContact O-N 2.78Å; I86-D89 VanDerWaalsContact O-N 3.13Å; L87-D89 VanDerWaalsContact C-N 3.35Å; L87-D89 PolarHBondContact O-N 3.15Å; D89-R93 VanDerWaalsContact CG-NH1 3.25Å; D89-R93 WeakPolarHBondContact O-CB 2.83Å; D89-R93 PolarHBondContact O-N 3.36Å; D89-R93 IonicContact OD1-CZ 2.91Å; D89-R93 IonicContact OD1-NE 3.87Å; D89-R93 IonicContact OD1-NH1 2.75Å; D89-R93 IonicContact OD1-NH2 3.23Å; D89-R93 PolarHBondContact OD1-NH2 3.24Å; D89-R93 IonicContact OD2-CZ 2.7Å; D89-R93 IonicContact OD2-NH1 3.38Å; D89-R93 PolarHBondContact OD2-NH1 2.95Å; D89-R93 IonicContact OD2-NH2 3.52Å; D89-R93 PolarHBondContact OD2-NH2 3.25Å; D89-K94 PolarHBondContact O-N 3.11Å
90	I	82.5	Confident	79.8	Confident	17 Å²	17	62.6 Å²	62.6	9%	0.087	32%	0.315	C	S	.	.	I	π-helix	trans	-63.6	-53.6	174.8	-67.5	167.1	0	0	0	110.1	L78 I86 L87 K92 K94 W95	L78-I90 HydrophobicContact CD2-CD1 3.87Å; I86-I90 HydrophobicContact CG2-CD1 3.88Å; I86-I90 HydrophobicContact CG2-CG1 4.4Å; I86-I90 WeakPolarHBondContact O-CG1 3.3Å; I86-I90 PolarHBondContact O-N 3.42Å; L87-I90 PolarHBondContact O-N 2.69Å; I90-K92 PolarHBondContact O-N 3.28Å; I90-K94 WeakPolarHBondContact O-CB 3.32Å; I90-K94 PolarHBondContact O-N 3.14Å; I90-K94 VanDerWaalsContact O-N 3.16Å; I90-W95 HydrophobicContact CG2-CD2 4.04Å; I90-W95 HydrophobicContact CG2-CE3 4.42Å; I90-W95 HydrophobicContact CG2-CG 4.46Å; I90-W95 HydrophobicContact CG2-CZ2 4.15Å; I90-W95 PolarHBondContact O-N 3.28Å
91	L	84.5	Confident	80	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.016	32%	0.323	C	S	.	.	I	π-helix	trans	-61.5	-47.2	-177.7	-68.6	172.9	0	0	0	112.7	L87 W95 L97 F167 F259 I263 W266	L87-L91 WeakPolarHBondContact O-CG 3.11Å; L87-L91 PolarHBondContact O-N 3.11Å; L87-L91 VanDerWaalsContact O-N 3.12Å; L91-W95 HydrophobicContact CD2-CE3 3.75Å; L91-W95 HydrophobicContact CD2-CZ3 3.91Å; L91-L97 HydrophobicContact CD2-CD1 4.08Å; L91-L97 PolarHBondContact O-N 3.21Å; L91-F167 HydrophobicContact CD2-CE1 4.09Å; L91-F259 HydrophobicContact CD1-CE2 4.02Å; L91-F259 HydrophobicContact CD2-CE2 3.98Å; L91-F259 HydrophobicContact CD2-CZ 4.21Å; L91-F259 HydrophobicContact CG-CE2 4.33Å; L91-I263 HydrophobicContact CD1-CG1 3.83Å; L91-W266 HydrophobicContact CB-CH2 3.92Å; L91-W266 HydrophobicContact CB-CZ3 3.73Å; L91-W266 HydrophobicContact CD1-CZ3 4.3Å
92	K	81.2	Confident	80.5	Confident	139 Å²	139	58.8 Å²	58.8	60%	0.604	30%	0.299	S	S	*	.	I	π-helix	trans	-82.5	-47.8	-173.1	-173.5	174.8	-179.8	175.5	0	113.5	R88 I90 W266	R88-K92 VanDerWaalsContact O-CB 3.29Å; R88-K92 WeakPolarHBondContact O-CB 3.47Å; R88-K92 PolarHBondContact O-N 3.41Å; I90-K92 PolarHBondContact O-N 3.28Å; K92-W266 HydrophobicContact CB-CH2 4.46Å; K92-W266 HydrophobicContact CB-CZ2 3.98Å; K92-W266 HydrophobicContact CG-CZ2 4.2Å
93	R	78.5	Confident	80.9	Confident	176 Å²	176	57.9 Å²	57.9	66%	0.664	29%	0.293	S	S	*	.	I	π-helix	trans	-94.6	-36.1	-172.5	-58.5	-166.2	-150.7	120	11.9	113.3	D89	D89-R93 VanDerWaalsContact CG-NH1 3.25Å; D89-R93 WeakPolarHBondContact O-CB 2.83Å; D89-R93 PolarHBondContact O-N 3.36Å; D89-R93 IonicContact OD1-CZ 2.91Å; D89-R93 IonicContact OD1-NE 3.87Å; D89-R93 IonicContact OD1-NH1 2.75Å; D89-R93 IonicContact OD1-NH2 3.23Å; D89-R93 PolarHBondContact OD1-NH2 3.24Å; D89-R93 IonicContact OD2-CZ 2.7Å; D89-R93 IonicContact OD2-NH1 3.38Å; D89-R93 PolarHBondContact OD2-NH1 2.95Å; D89-R93 IonicContact OD2-NH2 3.52Å; D89-R93 PolarHBondContact OD2-NH2 3.25Å
94	K	77.1	Confident	81.4	Confident	125 Å²	125	55 Å²	55	54%	0.543	28%	0.275	S	S	.	.	I	π-helix	trans	-90.7	-48.3	-173.6	-66.5	-70.3	-172.8	173.3	0	112.6	M61 D89 I90	M61-K94 HydrophobicContact SD-CB 4.13Å; D89-K94 PolarHBondContact O-N 3.11Å; I90-K94 WeakPolarHBondContact O-CB 3.32Å; I90-K94 PolarHBondContact O-N 3.14Å; I90-K94 VanDerWaalsContact O-N 3.16Å
95	W	84.4	Confident	81.9	Confident	10 Å²	10	52.9 Å²	52.9	4%	0.038	26%	0.263	C	S	.	.	S	Bend	trans	-84.4	-18.1	178.4	-66.9	-9	0	0	0	113.2	M61 R74 C76 I90 L91 L97 F167 F236 V238	M61-W95 VanDerWaalsContact CE-CD1 3.42Å; M61-W95 VanDerWaalsContact CE-NE1 3.28Å; R74-W95 PolarHBondContact NH1-O 2.92Å; C76-W95 HydrophobicContact CB-CZ2 4.25Å; I90-W95 HydrophobicContact CG2-CD2 4.04Å; I90-W95 HydrophobicContact CG2-CE3 4.42Å; I90-W95 HydrophobicContact CG2-CG 4.46Å; I90-W95 HydrophobicContact CG2-CZ2 4.15Å; I90-W95 PolarHBondContact O-N 3.28Å; L91-W95 HydrophobicContact CD2-CE3 3.75Å; L91-W95 HydrophobicContact CD2-CZ3 3.91Å; W95-L97 VanDerWaalsContact C-N 3.34Å; W95-L97 HydrophobicContact CB-CD1 3.86Å; W95-L97 HydrophobicContact CB-CG 3.82Å; W95-L97 HydrophobicContact CE3-CD1 3.94Å; W95-L97 PolarHBondContact O-N 3.49Å; W95-F167 AromaticContact CE3-CE1 3.95Å; W95-F167 HydrophobicContact CE3-CE1 3.95Å; W95-F167 HydrophobicContact CZ3-CD1 4Å; W95-F167 AromaticContact CZ3-CE1 3.64Å; W95-F167 HydrophobicContact CZ3-CE1 3.64Å; W95-F236 HydrophobicContact CB-CE1 4.23Å; W95-F236 AromaticContact CD2-CD1 3.67Å; W95-F236 HydrophobicContact CD2-CD1 3.67Å; W95-F236 HydrophobicContact CD2-CE1 4.06Å; W95-F236 HydrophobicContact CE3-CB 4.35Å; W95-F236 AromaticContact CE3-CD1 3.54Å; W95-F236 HydrophobicContact CE3-CD1 3.54Å; W95-F236 HydrophobicContact CE3-CE1 4.15Å; W95-F236 HydrophobicContact CE3-CG 4.05Å; W95-F236 HydrophobicContact CG-CD1 4.21Å; W95-F236 HydrophobicContact CG-CE1 4.12Å; W95-F236 HydrophobicContact CH2-CB 4.02Å; W95-F236 HydrophobicContact CH2-CD1 4.27Å; W95-F236 HydrophobicContact CZ2-CD1 4.36Å; W95-F236 HydrophobicContact CZ3-CB 3.83Å; W95-F236 AromaticContact CZ3-CD1 3.89Å; W95-F236 HydrophobicContact CZ3-CD1 3.89Å; W95-F236 HydrophobicContact CZ3-CG 4.05Å; W95-V238 HydrophobicContact CH2-CG2 4.07Å
96	G	80.4	Confident	82.6	Confident	58 Å²	58	49.9 Å²	49.9	60%	0.598	24%	0.242	S	C	*	.			trans	70.2	28.6	173.2	0	0	0	0	0	113.9
97	L	82.8	Confident	83	Confident	22 Å²	22	47.9 Å²	47.9	12%	0.115	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-82	144.2	-171.5	-59.7	169.6	0	0	0	112.1	L91 W95 W134 M165 F167 F236 W266	L91-L97 HydrophobicContact CD2-CD1 4.08Å; L91-L97 PolarHBondContact O-N 3.21Å; W95-L97 VanDerWaalsContact C-N 3.34Å; W95-L97 HydrophobicContact CB-CD1 3.86Å; W95-L97 HydrophobicContact CB-CG 3.82Å; W95-L97 HydrophobicContact CE3-CD1 3.94Å; W95-L97 PolarHBondContact O-N 3.49Å; L97-W134 HydrophobicContact CB-CH2 3.66Å; L97-W134 HydrophobicContact CB-CZ2 3.82Å; L97-W134 HydrophobicContact CD1-CH2 3.83Å; L97-W134 HydrophobicContact CD1-CZ2 4.33Å; L97-W134 HydrophobicContact CD1-CZ3 4.45Å; L97-W134 HydrophobicContact CG-CH2 4.33Å; L97-M165 HydrophobicContact CD2-CE 4.13Å; L97-M165 HydrophobicContact CD2-SD 4.09Å; L97-F167 HydrophobicContact CD1-CE1 4.01Å; L97-F167 HydrophobicContact CD1-CZ 3.66Å; L97-F236 HydrophobicContact CD1-CE2 4.46Å; L97-F236 HydrophobicContact CD1-CZ 4.36Å; L97-F236 HydrophobicContact CD2-CE1 4.3Å; L97-F236 HydrophobicContact CD2-CE2 3.9Å; L97-F236 HydrophobicContact CD2-CZ 3.56Å; L97-F236 HydrophobicContact CG-CZ 4.43Å; L97-W266 HydrophobicContact CB-CH2 3.97Å; L97-W266 VanDerWaalsContact O-CH2 3.3Å; L97-W266 WeakPolarHBondContact O-CH2 3.35Å; L97-W266 VanDerWaalsContact O-CZ2 3.25Å; L97-W266 WeakPolarHBondContact O-CZ2 3.46Å
98	K	78.2	Confident	83.1	Confident	178 Å²	178	48.1 Å²	48.1	77%	0.774	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-81.9	145.6	170.3	-68.3	179.9	-178.5	174.2	0	109.7	W134	K98-W134 WeakPolarHBondContact O-CZ2 3.35Å
99	P	76.5	Confident	83	Confident	44 Å²	44	43.9 Å²	43.9	29%	0.286	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-58.5	136.8	177.9	24.8	-33.9	0	0	0	111.6	W266 C268	P99-W266 HydrophobicContact CB-CD2 4.17Å; P99-W266 HydrophobicContact CB-CG 4.01Å; P99-C268 VanDerWaalsContact CG-SG 3.6Å
100	P	80.1	Confident	82.7	Confident	7 Å²	7	45.8 Å²	45.8	5%	0.045	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-69.2	157.6	175.9	20.4	-25.2	0	0	0	113.2	I103 W134 I263 V405	P100-I103 HydrophobicContact CG-CG1 4.07Å; P100-W134 HydrophobicContact CB-CB 4.12Å; P100-W134 HydrophobicContact CB-CD2 3.63Å; P100-W134 HydrophobicContact CB-CE3 4.28Å; P100-W134 HydrophobicContact CB-CG 3.54Å; P100-W134 HydrophobicContact CG-CB 4.45Å; P100-W134 HydrophobicContact CG-CD2 3.51Å; P100-W134 HydrophobicContact CG-CE3 3.63Å; P100-W134 HydrophobicContact CG-CG 3.91Å; P100-W134 HydrophobicContact CG-CH2 4.49Å; P100-W134 HydrophobicContact CG-CZ2 4.4Å; P100-W134 HydrophobicContact CG-CZ3 4.12Å; P100-I263 HydrophobicContact CG-CG2 3.57Å; P100-V405 HydrophobicContact CB-CG1 4.42Å; P100-V405 HydrophobicContact CG-CG1 4.17Å; P100-V405 VanDerWaalsContact O-CG1 3.31Å; P100-V405 WeakPolarHBondContact O-CG1 3.26Å; P100-V405 WeakPolarHBondContact O-CG2 3.42Å
101	T	77.8	Confident	82.3	Confident	54 Å²	54	45.2 Å²	45.2	33%	0.331	23%	0.228	S	C	.	.	S	Bend	trans	-86.6	-28	169.5	54.1	0	0	0	0	112.9	S131 G132 P406	T101-S131 WeakPolarHBondContact CB-O 3.37Å; T101-S131 WeakPolarHBondContact CG2-O 2.96Å; T101-S131 PolarHBondContact OG1-O 3.24Å; T101-G132 PolarHBondContact OG1-O 3.34Å; T101-P406 WeakPolarHBondContact O-CD 3.46Å; T101-P406 WeakPolarHBondContact O-CG 3.27Å
102	L	84.3	Confident	81.2	Confident	3 Å²	3	51 Å²	51	2%	0.016	25%	0.254	C	S	.	.			trans	-150.3	139.6	-179.7	174.4	63.7	0	0	0	109.6	I104 C133 W134 P406 L529 L553	L102-I104 HydrophobicContact CD2-CD1 4.06Å; L102-I104 HydrophobicContact CD2-CG1 4Å; L102-I104 HydrophobicContact CG-CG1 4.07Å; L102-C133 HydrophobicContact CB-CB 4.01Å; L102-C133 HydrophobicContact CD2-CB 4.35Å; L102-C133 HydrophobicContact CG-CB 4.3Å; L102-C133 CarbonylContact O-C 3.47Å; L102-C133 WeakPolarHBondContact O-CA 3.3Å; L102-C133 WeakPolarHBondContact O-CB 3.2Å; L102-W134 PolarHBondContact O-N 2.81Å; L102-P406 HydrophobicContact CD1-CB 4.3Å; L102-P406 HydrophobicContact CD1-CG 4.19Å; L102-L529 HydrophobicContact CD1-CD1 3.56Å; L102-L529 HydrophobicContact CD1-CD2 4.45Å; L102-L553 HydrophobicContact CB-CD2 4.22Å; L102-L553 HydrophobicContact CD2-CD2 4.18Å
103	I	88.2	Confident	80.3	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.5	172.4	-54.2	162.5	0	0	0	108.3	P100 W134 V136 I263 V405 P406 M407 C408	P100-I103 HydrophobicContact CG-CG1 4.07Å; I103-W134 WeakPolarHBondContact CA-O 3.41Å; I103-V136 HydrophobicContact CG2-CG2 4.16Å; I103-I263 HydrophobicContact CD1-CB 3.79Å; I103-I263 HydrophobicContact CD1-CG2 3.42Å; I103-I263 VanDerWaalsContact CD1-CG2 3.42Å; I103-I263 HydrophobicContact CG1-CG2 3.9Å; I103-V405 HydrophobicContact CD1-CB 4.35Å; I103-V405 HydrophobicContact CD1-CG1 4.1Å; I103-V405 HydrophobicContact CG1-CG1 3.97Å; I103-P406 PolarHBondContact N-O 3.06Å; I103-M407 HydrophobicContact CB-CB 4.25Å; I103-M407 HydrophobicContact CB-CG 4.14Å; I103-M407 HydrophobicContact CD1-CE 4.17Å; I103-M407 HydrophobicContact CG2-CG 4.15Å; I103-M407 WeakPolarHBondContact O-CA 3.17Å; I103-C408 PolarHBondContact O-N 3.41Å
104	I	90.1	Very high	79.8	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	112.3	172.9	-57.5	177.8	0	0	0	107.6	L102 V106 L125 A128 C133 W134 I135 V136 C408	L102-I104 HydrophobicContact CD2-CD1 4.06Å; L102-I104 HydrophobicContact CD2-CG1 4Å; L102-I104 HydrophobicContact CG-CG1 4.07Å; I104-V106 HydrophobicContact CG2-CG2 4.07Å; I104-L125 HydrophobicContact CD1-CD2 4.44Å; I104-L125 HydrophobicContact CG2-CD2 4.37Å; I104-A128 HydrophobicContact CD1-CB 3.61Å; I104-C133 HydrophobicContact CD1-CB 4.39Å; I104-W134 PolarHBondContact N-O 3.13Å; I104-I135 CarbonylContact O-C 3.59Å; I104-I135 VanDerWaalsContact O-CA 3.29Å; I104-I135 WeakPolarHBondContact O-CA 3.42Å; I104-V136 PolarHBondContact O-N 3.36Å; I104-C408 WeakPolarHBondContact CA-O 3.03Å
105	T	91.7	Very high	79.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	115	175.6	-175.3	0	0	0	0	109.2	F107 V136 R256 E260 C408 G409 L410	T105-F107 HydrophobicContact CG2-CD2 4.43Å; T105-F107 HydrophobicContact CG2-CE2 3.48Å; T105-F107 VanDerWaalsContact CG2-CE2 3.48Å; T105-F107 HydrophobicContact CG2-CZ 3.62Å; T105-F107 WeakPolarHBondContact OG1-CZ 3.49Å; T105-V136 CarbonylContact C-O 3.51Å; T105-V136 WeakPolarHBondContact CA-O 3.49Å; T105-R256 PolarHBondContact OG1-NE 2.97Å; T105-R256 PolarHBondContact OG1-NH2 3.16Å; T105-E260 WeakPolarHBondContact CB-OE1 3.27Å; T105-E260 PolarHBondContact OG1-OE1 2.94Å; T105-C408 PolarHBondContact N-O 3.38Å; T105-G409 VanDerWaalsContact CG2-CA 3.42Å; T105-G409 CarbonylContact O-C 3.59Å; T105-G409 WeakPolarHBondContact O-CA 3.45Å; T105-L410 PolarHBondContact O-N 3.19Å
106	V	91.6	Very high	79.4	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.6	-176.6	-177.3	0	0	0	0	108.7	I104 F121 I135 V136 T137 V144 T148 R256	I104-V106 HydrophobicContact CG2-CG2 4.07Å; V106-F121 HydrophobicContact CG1-CZ 4.2Å; V106-I135 HydrophobicContact CG2-CG2 3.88Å; V106-V136 PolarHBondContact N-O 2.82Å; V106-T137 HydrophobicContact CB-CG2 4.36Å; V106-V144 HydrophobicContact CG1-CG1 3.41Å; V106-V144 VanDerWaalsContact CG1-CG1 3.41Å; V106-T148 HydrophobicContact CG2-CG2 4.44Å; V106-R256 PolarHBondContact O-NH2 3.28Å
107	F	90	Very high	79.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.6	176.8	-56.8	-73.2	0	0	0	108.9	T105 L410 V411 V412 T418 Q421 V422 I433	T105-F107 HydrophobicContact CG2-CD2 4.43Å; T105-F107 HydrophobicContact CG2-CE2 3.48Å; T105-F107 VanDerWaalsContact CG2-CE2 3.48Å; T105-F107 HydrophobicContact CG2-CZ 3.62Å; T105-F107 WeakPolarHBondContact OG1-CZ 3.49Å; F107-L410 PolarHBondContact N-O 3.43Å; F107-V411 HydrophobicContact CB-CG2 4.19Å; F107-V411 HydrophobicContact CD2-CG2 4.09Å; F107-V411 WeakPolarHBondContact O-CA 3.46Å; F107-V412 PolarHBondContact O-N 2.85Å; F107-T418 HydrophobicContact CB-CG2 3.81Å; F107-Q421 HydrophobicContact CD1-CB 3.78Å; F107-Q421 HydrophobicContact CE1-CB 3.86Å; F107-V422 HydrophobicContact CB-CG2 4.24Å; F107-V422 HydrophobicContact CD2-CG2 3.96Å; F107-V422 HydrophobicContact CE2-CG2 4.44Å; F107-V422 HydrophobicContact CG-CG2 4.04Å; F107-I433 HydrophobicContact CE2-CD1 3.99Å
108	G	84	Confident	79.2	Confident	8 Å²	8	53.5 Å²	53.5	8%	0.082	25%	0.247	C	C	.	.			trans	153.2	157.5	-179.7	0	0	0	0	0	114.2	V412	G108-V412 WeakPolarHBondContact CA-O 3.33Å
109	T	78.2	Confident	79.4	Confident	14 Å²	14	49.9 Å²	49.9	9%	0.086	23%	0.234	C	C	.	.			trans	-112.3	-146	171.3	53.8	0	0	0	0	109.3	V144 G414 D415	T109-V144 VanDerWaalsContact O-CG2 3.22Å; T109-V144 WeakPolarHBondContact O-CG2 3.39Å; T109-V144 PolarHBondContact O-N 2.72Å; T109-V144 VanDerWaalsContact O-N 3.1Å; T109-G414 VanDerWaalsContact OG1-CA 3.3Å; T109-G414 WeakPolarHBondContact OG1-CA 3.49Å; T109-D415 HydrophobicContact CG2-CB 4.32Å
110	D	74.1	Confident	79.8	Confident	96 Å²	96	48.7 Å²	48.7	51%	0.513	23%	0.225	S	C	.	.			trans	-77.1	145.6	-179.3	-160.3	10.1	0	0	0	113.2	G143	D110-G143 WeakPolarHBondContact OD1-CA 3.26Å
111	F	74.5	Confident	80.1	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.026	22%	0.223	C	C	.	.			trans	-146.2	110.5	168.2	77.7	-75.8	0	0	0	107.6	K113 K118 V144 L147 V412	F111-K113 HydrophobicContact CD2-CB 4.29Å; F111-K113 PolarHBondContact O-N 2.76Å; F111-K118 HydrophobicContact CE2-CG 4.41Å; F111-K118 HydrophobicContact CZ-CG 4.33Å; F111-V144 HydrophobicContact CD1-CG2 3.41Å; F111-V144 VanDerWaalsContact CD1-CG2 3.41Å; F111-V144 HydrophobicContact CE1-CB 4.45Å; F111-V144 HydrophobicContact CE1-CG2 3.49Å; F111-V144 VanDerWaalsContact CE1-CG2 3.49Å; F111-L147 HydrophobicContact CE1-CD1 3.47Å; F111-L147 VanDerWaalsContact CE1-CD1 3.47Å; F111-L147 HydrophobicContact CZ-CD1 3.58Å; F111-V412 HydrophobicContact CD1-CG1 3.81Å; F111-V412 HydrophobicContact CE1-CG1 3.73Å; F111-V412 HydrophobicContact CG-CG1 4.3Å; F111-V412 HydrophobicContact CZ-CG1 4.18Å
112	E	61.3	Low	80.5	Confident	123 Å²	123	47.2 Å²	47.2	58%	0.575	21%	0.213	S	C	*	.			trans	-92.6	95.6	160	176.2	41.3	61.7	0	0	108.9	K114 K118	E112-K114 PolarHBondContact OE2-N 2.95Å; E112-K118 WeakPolarHBondContact OE1-CE 3.37Å; E112-K118 IonicContact OE1-NZ 3.58Å; E112-K118 PolarHBondContact OE1-NZ 3.2Å
113	K	63	Low	80.5	Confident	55 Å²	55	52.2 Å²	52.2	24%	0.239	24%	0.235	C	C	.	.			trans	-134.7	111.5	164.8	-59.7	-175.2	-173.3	-179	0	109.6	F111 L117 G438 S440	F111-K113 HydrophobicContact CD2-CB 4.29Å; F111-K113 PolarHBondContact O-N 2.76Å; K113-L117 HydrophobicContact CB-CD1 3.66Å; K113-L117 WeakPolarHBondContact O-CB 3.3Å; K113-L117 WeakPolarHBondContact O-CD1 3.38Å; K113-G438 WeakPolarHBondContact CD-O 3.25Å; K113-G438 PolarHBondContact NZ-O 3.27Å; K113-S440 WeakPolarHBondContact CE-OG 3.48Å; K113-S440 VanDerWaalsContact NZ-CB 3.28Å; K113-S440 VanDerWaalsContact NZ-N 3.14Å; K113-S440 PolarHBondContact NZ-OG 3.34Å
114	K	67.3	Low	80.2	Confident	99 Å²	99	52.4 Å²	52.4	43%	0.43	24%	0.237	S	C	.	.			trans	58.7	117.6	154.7	-36.8	172.5	-154.3	171.4	0	114.4	E112 K116 L117 K118 E516	E112-K114 PolarHBondContact OE2-N 2.95Å; K114-K116 PolarHBondContact O-N 3.18Å; K114-L117 HydrophobicContact CB-CD1 3.88Å; K114-L117 HydrophobicContact CB-CG 4.06Å; K114-L117 HydrophobicContact CD-CD1 3.54Å; K114-L117 HydrophobicContact CD-CG 4.14Å; K114-L117 HydrophobicContact CG-CD1 3.78Å; K114-L117 HydrophobicContact CG-CG 4.43Å; K114-L117 PolarHBondContact O-N 3.43Å; K114-K118 PolarHBondContact O-N 2.85Å; K114-E516 IonicContact NZ-OE1 2.86Å; K114-E516 PolarHBondContact NZ-OE1 2.59Å
115	R	75.6	Confident	80	Confident	230 Å²	230	52.4 Å²	52.4	87%	0.868	24%	0.237	S	C	*	.	H	α-helix	trans	-45.8	-33.4	173.8	-170.7	178.3	-179.6	179.6	2	113.9	M119	R115-M119 PolarHBondContact O-N 3.47Å
116	K	77.9	Confident	79.6	Confident	133 Å²	133	55.6 Å²	55.6	58%	0.578	25%	0.249	S	C	*	.	H	α-helix	trans	-60.3	-46.5	174.1	-171.9	-178.1	179.4	-173.4	0	112.9	K114 M119 I120	K114-K116 PolarHBondContact O-N 3.18Å; K116-M119 WeakPolarHBondContact O-CB 3.49Å; K116-M119 PolarHBondContact O-N 2.9Å; K116-I120 HydrophobicContact CG-CD1 4.17Å; K116-I120 WeakPolarHBondContact O-CG1 3.26Å; K116-I120 PolarHBondContact O-N 3.38Å
117	L	77.2	Confident	78.9	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-67.8	-41.6	-178	-66.1	168.8	0	0	0	111.4	K113 K114 M119 I120 F121 M515	K113-L117 HydrophobicContact CB-CD1 3.66Å; K113-L117 WeakPolarHBondContact O-CB 3.3Å; K113-L117 WeakPolarHBondContact O-CD1 3.38Å; K114-L117 HydrophobicContact CB-CD1 3.88Å; K114-L117 HydrophobicContact CB-CG 4.06Å; K114-L117 HydrophobicContact CD-CD1 3.54Å; K114-L117 HydrophobicContact CD-CG 4.14Å; K114-L117 HydrophobicContact CG-CD1 3.78Å; K114-L117 HydrophobicContact CG-CG 4.43Å; K114-L117 PolarHBondContact O-N 3.43Å; L117-M119 VanDerWaalsContact C-N 3.26Å; L117-M119 PolarHBondContact O-N 2.79Å; L117-I120 PolarHBondContact O-N 2.83Å; L117-F121 PolarHBondContact O-N 3.3Å; L117-M515 HydrophobicContact CB-CE 3.79Å; L117-M515 HydrophobicContact CD2-CB 3.4Å; L117-M515 VanDerWaalsContact CD2-CB 3.4Å; L117-M515 HydrophobicContact CD2-CE 3.75Å; L117-M515 HydrophobicContact CD2-CG 4.41Å; L117-M515 WeakPolarHBondContact CD2-O 3.22Å; L117-M515 HydrophobicContact CD2-SD 4.28Å; L117-M515 HydrophobicContact CG-CE 4.38Å; L117-M515 WeakPolarHBondContact O-CE 3.5Å
118	K	82	Confident	78.2	Confident	60 Å²	60	59.4 Å²	59.4	26%	0.261	27%	0.268	S	S	.	.	H	α-helix	trans	-57.1	-41.1	172	-66.2	-174.4	-179.2	-177.9	0	111.5	F111 E112 K114 K122 L147	F111-K118 HydrophobicContact CE2-CG 4.41Å; F111-K118 HydrophobicContact CZ-CG 4.33Å; E112-K118 WeakPolarHBondContact OE1-CE 3.37Å; E112-K118 IonicContact OE1-NZ 3.58Å; E112-K118 PolarHBondContact OE1-NZ 3.2Å; K114-K118 PolarHBondContact O-N 2.85Å; K118-K122 WeakPolarHBondContact O-CG 3.27Å; K118-K122 PolarHBondContact O-N 2.81Å; K118-L147 HydrophobicContact CD-CD1 4.22Å; K118-L147 HydrophobicContact CD-CD2 3.94Å; K118-L147 HydrophobicContact CG-CD1 4.11Å; K118-L147 HydrophobicContact CG-CD2 4.33Å
119	M	82.1	Confident	77.6	Confident	102 Å²	102	59 Å²	59	50%	0.502	27%	0.265	S	S	.	.	H	α-helix	trans	-68.1	-40.3	176.8	-170.9	63.7	-178.5	0	0	112.6	R115 K116 L117 K122 K123 W126	R115-M119 PolarHBondContact O-N 3.47Å; K116-M119 WeakPolarHBondContact O-CB 3.49Å; K116-M119 PolarHBondContact O-N 2.9Å; L117-M119 VanDerWaalsContact C-N 3.26Å; L117-M119 PolarHBondContact O-N 2.79Å; M119-K122 PolarHBondContact O-N 3.3Å; M119-K123 WeakPolarHBondContact O-CB 2.91Å; M119-K123 PolarHBondContact O-N 3.37Å; M119-W126 HydrophobicContact CE-CZ3 4.23Å
120	I	84.1	Confident	77.1	Confident	20 Å²	20	66 Å²	66	10%	0.103	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-45.8	175.6	-68.1	165.9	0	0	0	110.2	K116 L117 K123 G124 F513 M515	K116-I120 HydrophobicContact CG-CD1 4.17Å; K116-I120 WeakPolarHBondContact O-CG1 3.26Å; K116-I120 PolarHBondContact O-N 3.38Å; L117-I120 PolarHBondContact O-N 2.83Å; I120-K123 PolarHBondContact O-N 3.29Å; I120-G124 PolarHBondContact O-N 3.15Å; I120-F513 HydrophobicContact CG2-CZ 4.44Å; I120-M515 HydrophobicContact CB-CE 4.45Å; I120-M515 HydrophobicContact CG2-CE 4.43Å
121	F	86.1	Confident	76.6	Confident	1 Å²	1	62.5 Å²	62.5	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-51.4	176.6	179	-98.9	0	0	0	112.2	V106 L117 K123 G124 L125 V144 L147 L410 V412 M515 L521	V106-F121 HydrophobicContact CG1-CZ 4.2Å; L117-F121 PolarHBondContact O-N 3.3Å; F121-K123 PolarHBondContact O-N 3.41Å; F121-G124 PolarHBondContact O-N 3.41Å; F121-L125 HydrophobicContact CD1-CD1 4.15Å; F121-L125 HydrophobicContact CE1-CD1 3.52Å; F121-L125 HydrophobicContact CE1-CG 4.41Å; F121-L125 HydrophobicContact CE2-CD1 4.42Å; F121-L125 HydrophobicContact CZ-CD1 3.68Å; F121-L125 HydrophobicContact CZ-CG 4.36Å; F121-L125 PolarHBondContact O-N 3.12Å; F121-V144 HydrophobicContact CE1-CG1 4.42Å; F121-V144 HydrophobicContact CE2-CG1 4.43Å; F121-V144 HydrophobicContact CZ-CG1 3.85Å; F121-L147 HydrophobicContact CE1-CB 4.48Å; F121-L410 HydrophobicContact CD2-CD2 4.11Å; F121-L410 HydrophobicContact CE2-CD2 3.49Å; F121-L410 VanDerWaalsContact CE2-CD2 3.49Å; F121-L410 HydrophobicContact CE2-CG 4.45Å; F121-L410 HydrophobicContact CZ-CD2 4.45Å; F121-V412 HydrophobicContact CD2-CG2 4.08Å; F121-V412 HydrophobicContact CE2-CG2 3.73Å; F121-M515 HydrophobicContact CB-CE 4.45Å; F121-L521 HydrophobicContact CD2-CD2 4.3Å
122	K	86.9	Confident	76.6	Confident	28 Å²	28	63.1 Å²	63.1	12%	0.122	29%	0.287	C	S	.	.	H	α-helix	trans	-57.7	-46.4	176.6	-72.6	-166.7	173.9	-170.4	0	111.6	K118 M119 G124 L125 W126 E150 A151 D154	K118-K122 WeakPolarHBondContact O-CG 3.27Å; K118-K122 PolarHBondContact O-N 2.81Å; M119-K122 PolarHBondContact O-N 3.3Å; K122-G124 PolarHBondContact O-N 2.99Å; K122-L125 PolarHBondContact O-N 3.16Å; K122-W126 HydrophobicContact CB-CZ2 4.46Å; K122-W126 VanDerWaalsContact O-CG 3.23Å; K122-W126 PolarHBondContact O-N 3.46Å; K122-E150 IonicContact NZ-OE2 3.75Å; K122-E150 PolarHBondContact NZ-OE2 3.44Å; K122-A151 HydrophobicContact CB-CB 4.42Å; K122-A151 HydrophobicContact CD-CB 4.49Å; K122-A151 HydrophobicContact CG-CB 3.99Å; K122-D154 IonicContact NZ-OD2 3.83Å; K122-D154 PolarHBondContact NZ-OD2 2.53Å
123	K	84	Confident	77.7	Confident	108 Å²	108	57.2 Å²	57.2	47%	0.47	26%	0.26	S	S	.	.	H	α-helix	trans	-63.7	-39.8	178.9	-172.3	-177.8	179	-171	0	112.2	M119 I120 F121 W126 K127	M119-K123 WeakPolarHBondContact O-CB 2.91Å; M119-K123 PolarHBondContact O-N 3.37Å; I120-K123 PolarHBondContact O-N 3.29Å; F121-K123 PolarHBondContact O-N 3.41Å; K123-W126 PolarHBondContact O-N 3.25Å; K123-K127 WeakPolarHBondContact O-CG 3.48Å; K123-K127 PolarHBondContact O-N 2.73Å
124	G	81.9	Confident	78.9	Confident	5 Å²	5	54.9 Å²	54.9	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-43.1	175.4	0	0	0	0	0	112.4	I120 F121 K122 K127 A128	I120-G124 PolarHBondContact O-N 3.15Å; F121-G124 PolarHBondContact O-N 3.41Å; K122-G124 PolarHBondContact O-N 2.99Å; G124-K127 PolarHBondContact O-N 2.87Å; G124-A128 PolarHBondContact O-N 3.43Å
125	L	85.8	Confident	80.1	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-40.4	173.3	-70.3	-179.3	0	0	0	112.5	I104 F121 K122 A128 A129 I135 T148 A151 M164	I104-L125 HydrophobicContact CD1-CD2 4.44Å; I104-L125 HydrophobicContact CG2-CD2 4.37Å; F121-L125 HydrophobicContact CD1-CD1 4.15Å; F121-L125 HydrophobicContact CE1-CD1 3.52Å; F121-L125 HydrophobicContact CE1-CG 4.41Å; F121-L125 HydrophobicContact CE2-CD1 4.42Å; F121-L125 HydrophobicContact CZ-CD1 3.68Å; F121-L125 HydrophobicContact CZ-CG 4.36Å; F121-L125 PolarHBondContact O-N 3.12Å; K122-L125 PolarHBondContact O-N 3.16Å; L125-A128 PolarHBondContact O-N 3.1Å; L125-A129 PolarHBondContact O-N 3.29Å; L125-I135 HydrophobicContact CD2-CD1 4.3Å; L125-T148 HydrophobicContact CD1-CG2 4.22Å; L125-A151 HydrophobicContact CD1-CB 4.2Å; L125-M164 HydrophobicContact CB-CE 3.82Å
126	W	83.7	Confident	80.9	Confident	67 Å²	67	39.2 Å²	39.2	25%	0.254	19%	0.187	S	C	.	.	H	α-helix	trans	-62.9	-42	176.7	-66.6	-13.9	0	0	0	113	M119 K122 K123 A128 A129 A151 D154 Y155	M119-W126 HydrophobicContact CE-CZ3 4.23Å; K122-W126 HydrophobicContact CB-CZ2 4.46Å; K122-W126 VanDerWaalsContact O-CG 3.23Å; K122-W126 PolarHBondContact O-N 3.46Å; K123-W126 PolarHBondContact O-N 3.25Å; W126-A128 VanDerWaalsContact C-N 3.31Å; W126-A128 PolarHBondContact O-N 2.87Å; W126-A129 WeakPolarHBondContact O-CB 3.47Å; W126-A129 PolarHBondContact O-N 3.46Å; W126-A129 VanDerWaalsContact O-N 3.14Å; W126-A151 PolarHBondContact NE1-O 3.13Å; W126-D154 HydrophobicContact CZ2-CB 3.84Å; W126-Y155 HydrophobicContact CB-CD2 4.2Å; W126-Y155 AromaticContact CD1-CD2 3.86Å; W126-Y155 HydrophobicContact CG-CD2 4.1Å
127	K	76.9	Confident	81.6	Confident	68 Å²	68	32.9 Å²	32.9	30%	0.296	16%	0.16	S	C	.	.	H	α-helix	trans	-63.5	-38.2	175.7	-74.1	-177	-178.1	-178.6	0	111.6	K123 G124 A129 D520 D522	K123-K127 WeakPolarHBondContact O-CG 3.48Å; K123-K127 PolarHBondContact O-N 2.73Å; G124-K127 PolarHBondContact O-N 2.87Å; K127-A129 VanDerWaalsContact C-N 3.32Å; K127-D520 IonicContact NZ-OD1 2.63Å; K127-D520 PolarHBondContact NZ-OD1 2.85Å; K127-D522 HydrophobicContact CB-CB 4.09Å; K127-D522 HydrophobicContact CD-CB 4.25Å; K127-D522 WeakPolarHBondContact CD-OD1 2.99Å; K127-D522 VanDerWaalsContact CD-OD2 3.31Å; K127-D522 WeakPolarHBondContact CD-OD2 3.34Å; K127-D522 IonicContact NZ-OD1 2.87Å; K127-D522 PolarHBondContact NZ-OD1 2.86Å; K127-D522 IonicContact NZ-OD2 3.57Å
128	A	74.9	Confident	82	Confident	15 Å²	15	33 Å²	33	12%	0.124	16%	0.162	C	C	.	.	H	α-helix	trans	-68.6	-31	173.7	0	0	0	0	0	112.6	I104 G124 L125 W126 E130 S131	I104-A128 HydrophobicContact CD1-CB 3.61Å; G124-A128 PolarHBondContact O-N 3.43Å; L125-A128 PolarHBondContact O-N 3.1Å; W126-A128 VanDerWaalsContact C-N 3.31Å; W126-A128 PolarHBondContact O-N 2.87Å; A128-E130 PolarHBondContact O-N 3.23Å; A128-S131 WeakPolarHBondContact O-CB 3.3Å; A128-S131 PolarHBondContact O-N 3.09Å; A128-S131 VanDerWaalsContact O-N 3.11Å; A128-S131 PolarHBondContact O-OG 3.29Å
129	A	71.6	Confident	82.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-19.5	178.4	0	0	0	0	0	114.4	L125 W126 K127 S131 G132 Y155 M164	L125-A129 PolarHBondContact O-N 3.29Å; W126-A129 WeakPolarHBondContact O-CB 3.47Å; W126-A129 PolarHBondContact O-N 3.46Å; W126-A129 VanDerWaalsContact O-N 3.14Å; K127-A129 VanDerWaalsContact C-N 3.32Å; A129-S131 PolarHBondContact O-N 3.05Å; A129-S131 VanDerWaalsContact O-N 3.16Å; A129-G132 PolarHBondContact O-N 3.29Å; A129-Y155 HydrophobicContact CB-CD1 4.47Å; A129-Y155 HydrophobicContact CB-CD2 4.09Å; A129-Y155 HydrophobicContact CB-CE1 4.14Å; A129-Y155 HydrophobicContact CB-CE2 3.71Å; A129-Y155 HydrophobicContact CB-CG 4.45Å; A129-M164 HydrophobicContact CB-CB 3.99Å; A129-M164 HydrophobicContact CB-CG 4Å; A129-M164 HydrophobicContact CB-SD 3.73Å
130	E	68.2	Low	82.4	Confident	159 Å²	159	26 Å²	26	74%	0.743	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.2	171.1	-68.6	-168.9	168.3	0	0	112.7	A128	A128-E130 PolarHBondContact O-N 3.23Å
131	S	64.7	Low	82.5	Confident	24 Å²	24	27 Å²	27	17%	0.168	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-25.6	175.8	68.9	0	0	0	0	114.2	T101 A128 A129	T101-S131 WeakPolarHBondContact CB-O 3.37Å; T101-S131 WeakPolarHBondContact CG2-O 2.96Å; T101-S131 PolarHBondContact OG1-O 3.24Å; A128-S131 WeakPolarHBondContact O-CB 3.3Å; A128-S131 PolarHBondContact O-N 3.09Å; A128-S131 VanDerWaalsContact O-N 3.11Å; A128-S131 PolarHBondContact O-OG 3.29Å; A129-S131 PolarHBondContact O-N 3.05Å; A129-S131 VanDerWaalsContact O-N 3.16Å
132	G	72.8	Confident	82.3	Confident	18 Å²	18	29.7 Å²	29.7	19%	0.186	15%	0.147	C	C	.	.			trans	86.4	47.4	-163.9	0	0	0	0	0	113.9	T101 A129	T101-G132 PolarHBondContact OG1-O 3.34Å; A129-G132 PolarHBondContact O-N 3.29Å
133	C	84.2	Confident	82	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.146	C	C	.	.			trans	-79.4	152.5	-176.3	68.6	0	0	0	0	113.9	L102 I104	L102-C133 HydrophobicContact CB-CB 4.01Å; L102-C133 HydrophobicContact CD2-CB 4.35Å; L102-C133 HydrophobicContact CG-CB 4.3Å; L102-C133 CarbonylContact O-C 3.47Å; L102-C133 WeakPolarHBondContact O-CA 3.3Å; L102-C133 WeakPolarHBondContact O-CB 3.2Å; I104-C133 HydrophobicContact CD1-CB 4.39Å
134	W	89.7	Confident	82.1	Confident	5 Å²	5	23.6 Å²	23.6	2%	0.019	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	138.3	168.1	-70.2	8.3	0	0	0	110	L97 K98 P100 L102 I103 I104 M165 F167 I263 W266	L97-W134 HydrophobicContact CB-CH2 3.66Å; L97-W134 HydrophobicContact CB-CZ2 3.82Å; L97-W134 HydrophobicContact CD1-CH2 3.83Å; L97-W134 HydrophobicContact CD1-CZ2 4.33Å; L97-W134 HydrophobicContact CD1-CZ3 4.45Å; L97-W134 HydrophobicContact CG-CH2 4.33Å; K98-W134 WeakPolarHBondContact O-CZ2 3.35Å; P100-W134 HydrophobicContact CB-CB 4.12Å; P100-W134 HydrophobicContact CB-CD2 3.63Å; P100-W134 HydrophobicContact CB-CE3 4.28Å; P100-W134 HydrophobicContact CB-CG 3.54Å; P100-W134 HydrophobicContact CG-CB 4.45Å; P100-W134 HydrophobicContact CG-CD2 3.51Å; P100-W134 HydrophobicContact CG-CE3 3.63Å; P100-W134 HydrophobicContact CG-CG 3.91Å; P100-W134 HydrophobicContact CG-CH2 4.49Å; P100-W134 HydrophobicContact CG-CZ2 4.4Å; P100-W134 HydrophobicContact CG-CZ3 4.12Å; L102-W134 PolarHBondContact O-N 2.81Å; I103-W134 WeakPolarHBondContact CA-O 3.41Å; I104-W134 PolarHBondContact N-O 3.13Å; W134-M165 HydrophobicContact CD2-CE 4.32Å; W134-M165 HydrophobicContact CG-CE 4.47Å; W134-M165 HydrophobicContact CZ2-CE 3.6Å; W134-F167 HydrophobicContact CB-CE2 4.32Å; W134-F167 AromaticContact CD2-CE2 3.71Å; W134-F167 HydrophobicContact CD2-CE2 3.71Å; W134-F167 HydrophobicContact CD2-CZ 4.26Å; W134-F167 HydrophobicContact CE3-CD2 4.41Å; W134-F167 AromaticContact CE3-CE2 3.54Å; W134-F167 HydrophobicContact CE3-CE2 3.54Å; W134-F167 AromaticContact CE3-CZ 3.83Å; W134-F167 HydrophobicContact CE3-CZ 3.83Å; W134-F167 HydrophobicContact CG-CE2 4.07Å; W134-F167 HydrophobicContact CH2-CZ 4.25Å; W134-F167 HydrophobicContact CZ3-CE2 4.07Å; W134-F167 AromaticContact CZ3-CZ 3.85Å; W134-F167 HydrophobicContact CZ3-CZ 3.85Å; W134-I263 HydrophobicContact CE3-CD1 4.23Å; W134-I263 HydrophobicContact CE3-CG2 3.79Å; W134-I263 HydrophobicContact CZ3-CD1 4.39Å; W134-I263 HydrophobicContact CZ3-CG1 4.42Å; W134-I263 HydrophobicContact CZ3-CG2 3.9Å; W134-W266 HydrophobicContact CH2-CE3 4.16Å; W134-W266 HydrophobicContact CH2-CH2 4.1Å; W134-W266 AromaticContact CH2-CZ3 3.44Å; W134-W266 HydrophobicContact CH2-CZ3 3.44Å; W134-W266 VanDerWaalsContact CH2-CZ3 3.44Å; W134-W266 HydrophobicContact CZ3-CE3 4.28Å; W134-W266 AromaticContact CZ3-CZ3 3.81Å; W134-W266 HydrophobicContact CZ3-CZ3 3.81Å
135	I	91.9	Very high	82.4	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.8	-179.4	-56.4	-178.8	0	0	0	109.2	I104 V106 L125 T137 T148 V152 M164 M165 A166 F167	I104-I135 CarbonylContact O-C 3.59Å; I104-I135 VanDerWaalsContact O-CA 3.29Å; I104-I135 WeakPolarHBondContact O-CA 3.42Å; V106-I135 HydrophobicContact CG2-CG2 3.88Å; L125-I135 HydrophobicContact CD2-CD1 4.3Å; I135-T137 HydrophobicContact CG2-CG2 3.68Å; I135-T148 HydrophobicContact CD1-CG2 4.35Å; I135-T148 HydrophobicContact CG2-CG2 3.55Å; I135-V152 HydrophobicContact CD1-CG2 4.08Å; I135-M164 HydrophobicContact CD1-CE 3.23Å; I135-M164 HydrophobicContact CD1-CG 4Å; I135-M164 HydrophobicContact CD1-SD 4.42Å; I135-M165 PolarHBondContact N-O 2.95Å; I135-A166 CarbonylContact O-C 3.43Å; I135-A166 WeakPolarHBondContact O-CA 3.4Å; I135-F167 PolarHBondContact O-N 2.86Å
136	V	92.2	Very high	82.5	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	121.7	175.8	-176.6	0	0	0	0	108.1	I103 I104 T105 V106 F167 V169 R256 F259	I103-V136 HydrophobicContact CG2-CG2 4.16Å; I104-V136 PolarHBondContact O-N 3.36Å; T105-V136 CarbonylContact C-O 3.51Å; T105-V136 WeakPolarHBondContact CA-O 3.49Å; V106-V136 PolarHBondContact N-O 2.82Å; V136-F167 WeakPolarHBondContact CA-O 3.47Å; V136-F167 HydrophobicContact CG2-CB 4.45Å; V136-V169 HydrophobicContact CG1-CG2 3.94Å; V136-R256 HydrophobicContact CG1-CG 4.42Å; V136-R256 PolarHBondContact O-NH2 2.96Å; V136-F259 HydrophobicContact CG1-CD1 4.46Å; V136-F259 HydrophobicContact CG1-CE1 4.48Å; V136-F259 HydrophobicContact CG2-CE1 4.34Å
137	T	91.8	Very high	82.7	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	177.5	-179.3	96.6	0	0	0	0	110.2	V106 I135 G139 T148 F167 G168 V169 H234	V106-T137 HydrophobicContact CB-CG2 4.36Å; I135-T137 HydrophobicContact CG2-CG2 3.68Å; T137-G139 VanDerWaalsContact C-N 3.28Å; T137-G139 PolarHBondContact O-N 3.45Å; T137-G139 PolarHBondContact OG1-N 3.24Å; T137-T148 HydrophobicContact CG2-CG2 3.66Å; T137-F167 PolarHBondContact N-O 2.9Å; T137-G168 WeakPolarHBondContact O-CA 3.24Å; T137-V169 PolarHBondContact O-N 2.92Å; T137-H234 PolarHBondContact OG1-NE2 2.52Å
138	G	85.7	Confident	83.4	Confident	8 Å²	8	21.5 Å²	21.5	8%	0.082	12%	0.115	C	C	.	.			trans	-73.2	-11	172.8	0	0	0	0	0	115.1	F140 M145 V169 A170	G138-F140 VanDerWaalsContact C-N 3.3Å; G138-F140 WeakPolarHBondContact O-CD2 3.22Å; G138-F140 PolarHBondContact O-N 3.45Å; G138-M145 VanDerWaalsContact C-SD 3.6Å; G138-M145 WeakPolarHBondContact CA-SD 3.47Å; G138-V169 WeakPolarHBondContact CA-O 3.14Å; G138-A170 WeakPolarHBondContact O-CB 3.45Å
139	G	85.7	Confident	84	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.			trans	72.9	5.1	171.8	0	0	0	0	0	117.3	T137 D231 F237	T137-G139 VanDerWaalsContact C-N 3.28Å; T137-G139 PolarHBondContact O-N 3.45Å; T137-G139 PolarHBondContact OG1-N 3.24Å; G139-D231 PolarHBondContact O-N 3.07Å; G139-F237 WeakPolarHBondContact O-CE1 3.31Å
140	F	87.2	Confident	84.7	Confident	16 Å²	16	22.8 Å²	22.8	7%	0.07	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-87.9	153.6	175.3	-64	-69.7	0	0	0	111.8	G138 L142 M145 A170 C174 V175 R228 A229	G138-F140 VanDerWaalsContact C-N 3.3Å; G138-F140 WeakPolarHBondContact O-CD2 3.22Å; G138-F140 PolarHBondContact O-N 3.45Å; F140-L142 PolarHBondContact O-N 3.06Å; F140-M145 HydrophobicContact CB-CE 4.48Å; F140-M145 HydrophobicContact CB-SD 4.21Å; F140-M145 HydrophobicContact CD2-SD 4.32Å; F140-M145 WeakPolarHBondContact O-CB 3.42Å; F140-A170 HydrophobicContact CE1-CB 4.09Å; F140-A170 HydrophobicContact CE2-CB 3.88Å; F140-A170 HydrophobicContact CZ-CB 3.58Å; F140-C174 HydrophobicContact CE1-CB 4.24Å; F140-C174 HydrophobicContact CZ-CB 3.77Å; F140-V175 HydrophobicContact CE1-CG2 4.09Å; F140-R228 HydrophobicContact CB-CB 4.38Å; F140-R228 HydrophobicContact CD1-CB 3.52Å; F140-R228 HydrophobicContact CE1-CB 3.96Å; F140-R228 HydrophobicContact CG-CB 4.05Å; F140-A229 CarbonylContact C-O 3.58Å; F140-A229 WeakPolarHBondContact CA-O 3.48Å
141	H	86.3	Confident	85.7	Confident	41 Å²	41	15.2 Å²	15.2	19%	0.19	8%	0.084	C	C	.	.	S	Bend	trans	-76.5	46	177.5	-164.6	63.4	0	0	0	113.1	K146 A229 D231	H141-K146 VanDerWaalsContact CE1-CE 3.48Å; H141-K146 WeakPolarHBondContact CE1-CE 3.43Å; H141-K146 VanDerWaalsContact NE2-CE 3.35Å; H141-K146 WeakPolarHBondContact NE2-CE 3.39Å; H141-K146 PolarHBondContact NE2-NZ 3.04Å; H141-A229 PolarHBondContact N-O 3.39Å; H141-D231 HydrophobicContact CB-CB 4.27Å; H141-D231 IonicContact CE1-OD1 2.85Å; H141-D231 IonicContact CG-OD1 3.61Å; H141-D231 IonicContact ND1-OD1 3.45Å; H141-D231 PolarHBondContact ND1-OD1 2.82Å
142	L	82.2	Confident	86.8	Confident	57 Å²	57	14.2 Å²	14.2	30%	0.298	8%	0.076	S	C	.	.	S	Bend	trans	-132	135.7	-174.2	-174.6	68	0	0	0	111.9	F140 V144 M145 K146	F140-L142 PolarHBondContact O-N 3.06Å; L142-V144 PolarHBondContact O-N 3.47Å; L142-M145 WeakPolarHBondContact O-CB 3.41Å; L142-M145 PolarHBondContact O-N 3.49Å; L142-M145 VanDerWaalsContact O-N 3.12Å; L142-K146 PolarHBondContact O-N 2.96Å
143	G	80.8	Confident	87.4	Confident	9 Å²	9	16.8 Å²	16.8	9%	0.093	8%	0.08	C	C	.	.	H	α-helix	trans	55.8	-129.6	166.2	0	0	0	0	0	115.8	D110 M145 K146 L147	D110-G143 WeakPolarHBondContact OD1-CA 3.26Å; G143-M145 PolarHBondContact O-N 2.8Å; G143-K146 PolarHBondContact O-N 3.09Å; G143-L147 PolarHBondContact O-N 2.93Å; G143-L147 VanDerWaalsContact O-N 3.14Å
144	V	86.5	Confident	87.5	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-58	-33.8	177.8	-179.7	0	0	0	0	112.3	V106 T109 F111 F121 L142 L147 T148 V412	V106-V144 HydrophobicContact CG1-CG1 3.41Å; V106-V144 VanDerWaalsContact CG1-CG1 3.41Å; T109-V144 VanDerWaalsContact O-CG2 3.22Å; T109-V144 WeakPolarHBondContact O-CG2 3.39Å; T109-V144 PolarHBondContact O-N 2.72Å; T109-V144 VanDerWaalsContact O-N 3.1Å; F111-V144 HydrophobicContact CD1-CG2 3.41Å; F111-V144 VanDerWaalsContact CD1-CG2 3.41Å; F111-V144 HydrophobicContact CE1-CB 4.45Å; F111-V144 HydrophobicContact CE1-CG2 3.49Å; F111-V144 VanDerWaalsContact CE1-CG2 3.49Å; F121-V144 HydrophobicContact CE1-CG1 4.42Å; F121-V144 HydrophobicContact CE2-CG1 4.43Å; F121-V144 HydrophobicContact CZ-CG1 3.85Å; L142-V144 PolarHBondContact O-N 3.47Å; V144-L147 PolarHBondContact O-N 3.09Å; V144-T148 WeakPolarHBondContact O-CB 3.27Å; V144-T148 PolarHBondContact O-N 2.87Å; V144-T148 PolarHBondContact O-OG1 2.8Å; V144-V412 HydrophobicContact CG1-CB 4.24Å; V144-V412 HydrophobicContact CG2-CB 3.72Å; V144-V412 HydrophobicContact CG2-CG1 3.63Å
145	M	88.1	Confident	87.3	Confident	15 Å²	15	19.4 Å²	19.4	7%	0.074	9%	0.094	C	C	.	.	H	α-helix	trans	-66.5	-43.1	-178.6	-64.9	173.1	-95.5	0	0	110.9	G138 F140 L142 G143 T148 G149	G138-M145 VanDerWaalsContact C-SD 3.6Å; G138-M145 WeakPolarHBondContact CA-SD 3.47Å; F140-M145 HydrophobicContact CB-CE 4.48Å; F140-M145 HydrophobicContact CB-SD 4.21Å; F140-M145 HydrophobicContact CD2-SD 4.32Å; F140-M145 WeakPolarHBondContact O-CB 3.42Å; L142-M145 WeakPolarHBondContact O-CB 3.41Å; L142-M145 PolarHBondContact O-N 3.49Å; L142-M145 VanDerWaalsContact O-N 3.12Å; G143-M145 PolarHBondContact O-N 2.8Å; M145-T148 PolarHBondContact O-N 3.05Å; M145-G149 PolarHBondContact O-N 3.18Å
146	K	88	Confident	86.9	Confident	70 Å²	70	20.6 Å²	20.6	30%	0.304	10%	0.101	S	C	.	.	H	α-helix	trans	-60.8	-48.1	171.5	175.7	175.1	179.1	158.6	0	111.8	H141 L142 G143 T148 G149 E150	H141-K146 VanDerWaalsContact CE1-CE 3.48Å; H141-K146 WeakPolarHBondContact CE1-CE 3.43Å; H141-K146 VanDerWaalsContact NE2-CE 3.35Å; H141-K146 WeakPolarHBondContact NE2-CE 3.39Å; H141-K146 PolarHBondContact NE2-NZ 3.04Å; L142-K146 PolarHBondContact O-N 2.96Å; G143-K146 PolarHBondContact O-N 3.09Å; K146-T148 VanDerWaalsContact C-N 3.28Å; K146-T148 PolarHBondContact O-N 2.93Å; K146-G149 PolarHBondContact O-N 2.65Å; K146-E150 WeakPolarHBondContact O-CG 3.39Å; K146-E150 PolarHBondContact O-N 3.09Å
147	L	88.3	Confident	86.4	Confident	14 Å²	14	26.1 Å²	26.1	7%	0.073	13%	0.131	C	C	.	.	H	α-helix	trans	-61.6	-36	178.4	-72.9	169.9	0	0	0	112.9	F111 K118 F121 G143 V144 A151	F111-L147 HydrophobicContact CE1-CD1 3.47Å; F111-L147 VanDerWaalsContact CE1-CD1 3.47Å; F111-L147 HydrophobicContact CZ-CD1 3.58Å; K118-L147 HydrophobicContact CD-CD1 4.22Å; K118-L147 HydrophobicContact CD-CD2 3.94Å; K118-L147 HydrophobicContact CG-CD1 4.11Å; K118-L147 HydrophobicContact CG-CD2 4.33Å; F121-L147 HydrophobicContact CE1-CB 4.48Å; G143-L147 PolarHBondContact O-N 2.93Å; G143-L147 VanDerWaalsContact O-N 3.14Å; V144-L147 PolarHBondContact O-N 3.09Å; L147-A151 WeakPolarHBondContact O-CB 3.36Å; L147-A151 PolarHBondContact O-N 2.94Å
148	T	89.9	Confident	86	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68	-43.7	175.8	-58.1	0	0	0	0	110.9	V106 L125 I135 T137 V144 M145 K146 A151 V152	V106-T148 HydrophobicContact CG2-CG2 4.44Å; L125-T148 HydrophobicContact CD1-CG2 4.22Å; I135-T148 HydrophobicContact CD1-CG2 4.35Å; I135-T148 HydrophobicContact CG2-CG2 3.55Å; T137-T148 HydrophobicContact CG2-CG2 3.66Å; V144-T148 WeakPolarHBondContact O-CB 3.27Å; V144-T148 PolarHBondContact O-N 2.87Å; V144-T148 PolarHBondContact O-OG1 2.8Å; M145-T148 PolarHBondContact O-N 3.05Å; K146-T148 VanDerWaalsContact C-N 3.28Å; K146-T148 PolarHBondContact O-N 2.93Å; T148-A151 PolarHBondContact O-N 2.84Å; T148-V152 VanDerWaalsContact O-CG2 3.23Å; T148-V152 WeakPolarHBondContact O-CG2 3.19Å; T148-V152 PolarHBondContact O-N 2.76Å; T148-V152 VanDerWaalsContact O-N 3.14Å
149	G	87.8	Confident	85.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-47.9	172.8	0	0	0	0	0	112.4	M145 K146 A151 V152 R153 N233	M145-G149 PolarHBondContact O-N 3.18Å; K146-G149 PolarHBondContact O-N 2.65Å; G149-A151 VanDerWaalsContact C-N 3.34Å; G149-A151 PolarHBondContact O-N 3.28Å; G149-V152 WeakPolarHBondContact O-CB 3.49Å; G149-V152 PolarHBondContact O-N 2.95Å; G149-R153 PolarHBondContact O-N 2.87Å; G149-N233 VanDerWaalsContact O-CB 3.24Å; G149-N233 WeakPolarHBondContact O-CB 3.22Å
150	E	87.7	Confident	84.7	Confident	43 Å²	43	39 Å²	39	20%	0.201	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-42.1	174.5	-70.9	179.2	-173.3	0	0	112.4	K122 K146 V152 R153 D154	K122-E150 IonicContact NZ-OE2 3.75Å; K122-E150 PolarHBondContact NZ-OE2 3.44Å; K146-E150 WeakPolarHBondContact O-CG 3.39Å; K146-E150 PolarHBondContact O-N 3.09Å; E150-V152 PolarHBondContact O-N 2.88Å; E150-R153 PolarHBondContact O-N 3.35Å; E150-D154 WeakPolarHBondContact O-CB 3.35Å; E150-D154 PolarHBondContact O-N 2.86Å
151	A	88.6	Confident	83.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-37.1	178.2	0	0	0	0	0	112.3	K122 L125 W126 L147 T148 G149 Y155	K122-A151 HydrophobicContact CB-CB 4.42Å; K122-A151 HydrophobicContact CD-CB 4.49Å; K122-A151 HydrophobicContact CG-CB 3.99Å; L125-A151 HydrophobicContact CD1-CB 4.2Å; W126-A151 PolarHBondContact NE1-O 3.13Å; L147-A151 WeakPolarHBondContact O-CB 3.36Å; L147-A151 PolarHBondContact O-N 2.94Å; T148-A151 PolarHBondContact O-N 2.84Å; G149-A151 VanDerWaalsContact C-N 3.34Å; G149-A151 PolarHBondContact O-N 3.28Å; A151-Y155 WeakPolarHBondContact O-CB 3.44Å; A151-Y155 PolarHBondContact O-N 2.82Å; A151-Y155 VanDerWaalsContact O-N 3.08Å
152	V	87.8	Confident	82.6	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-70.6	-42.1	177.4	175.9	0	0	0	0	110.7	I135 T148 G149 E150 T156 M164 A166	I135-V152 HydrophobicContact CD1-CG2 4.08Å; T148-V152 VanDerWaalsContact O-CG2 3.23Å; T148-V152 WeakPolarHBondContact O-CG2 3.19Å; T148-V152 PolarHBondContact O-N 2.76Å; T148-V152 VanDerWaalsContact O-N 3.14Å; G149-V152 WeakPolarHBondContact O-CB 3.49Å; G149-V152 PolarHBondContact O-N 2.95Å; E150-V152 PolarHBondContact O-N 2.88Å; V152-T156 VanDerWaalsContact O-CB 3.31Å; V152-T156 WeakPolarHBondContact O-CB 3.33Å; V152-T156 PolarHBondContact O-N 2.87Å; V152-T156 PolarHBondContact O-OG1 3.18Å; V152-M164 HydrophobicContact CB-SD 4.42Å; V152-M164 HydrophobicContact CG2-CE 3.71Å; V152-M164 HydrophobicContact CG2-CG 4.05Å; V152-M164 HydrophobicContact CG2-SD 3.99Å; V152-A166 HydrophobicContact CG1-CB 4.49Å; V152-A166 HydrophobicContact CG2-CB 4.07Å
153	R	85.2	Confident	82.1	Confident	72 Å²	72	42.9 Å²	42.9	27%	0.272	24%	0.236	S	C	.	.	H	α-helix	trans	-62.6	-53.4	173.9	-177	-174.8	64.7	-156.2	5.8	111.2	G149 E150 Y155 T156 D157 N233	G149-R153 PolarHBondContact O-N 2.87Å; E150-R153 PolarHBondContact O-N 3.35Å; R153-Y155 PolarHBondContact O-N 3.12Å; R153-T156 WeakPolarHBondContact O-CA 3.35Å; R153-T156 PolarHBondContact O-N 3.13Å; R153-D157 PolarHBondContact O-N 2.86Å; R153-N233 HydrophobicContact CB-CB 4.47Å; R153-N233 WeakPolarHBondContact CD-OD1 3.29Å; R153-N233 PolarHBondContact NH1-OD1 3.12Å
154	D	85.9	Confident	82.3	Confident	49 Å²	49	42.4 Å²	42.4	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-55.6	-38.9	179.9	-63	-16.1	0	0	0	111	K122 W126 E150 A158	K122-D154 IonicContact NZ-OD2 3.83Å; K122-D154 PolarHBondContact NZ-OD2 2.53Å; W126-D154 HydrophobicContact CZ2-CB 3.84Å; E150-D154 WeakPolarHBondContact O-CB 3.35Å; E150-D154 PolarHBondContact O-N 2.86Å; D154-A158 VanDerWaalsContact O-CB 3.23Å; D154-A158 WeakPolarHBondContact O-CB 3.38Å; D154-A158 PolarHBondContact O-N 2.99Å
155	Y	86	Confident	82.3	Confident	11 Å²	11	43.9 Å²	43.9	4%	0.043	24%	0.239	C	C	.	.	H	α-helix	trans	-70.3	-41.7	175.1	-173.9	-88.3	0	0	0	113	W126 A129 A151 R153 D157 A158 Y159 R163 M164	W126-Y155 HydrophobicContact CB-CD2 4.2Å; W126-Y155 AromaticContact CD1-CD2 3.86Å; W126-Y155 HydrophobicContact CG-CD2 4.1Å; A129-Y155 HydrophobicContact CB-CD1 4.47Å; A129-Y155 HydrophobicContact CB-CD2 4.09Å; A129-Y155 HydrophobicContact CB-CE1 4.14Å; A129-Y155 HydrophobicContact CB-CE2 3.71Å; A129-Y155 HydrophobicContact CB-CG 4.45Å; A151-Y155 WeakPolarHBondContact O-CB 3.44Å; A151-Y155 PolarHBondContact O-N 2.82Å; A151-Y155 VanDerWaalsContact O-N 3.08Å; R153-Y155 PolarHBondContact O-N 3.12Å; Y155-D157 VanDerWaalsContact C-N 3.33Å; Y155-A158 PolarHBondContact O-N 2.86Å; Y155-Y159 HydrophobicContact CD1-CD2 4.48Å; Y155-Y159 AromaticContact CD2-CD2 3.63Å; Y155-Y159 HydrophobicContact CD2-CD2 3.63Å; Y155-Y159 AromaticContact CD2-CE2 3.9Å; Y155-Y159 HydrophobicContact CD2-CE2 3.9Å; Y155-Y159 HydrophobicContact CE1-CD2 4.4Å; Y155-Y159 AromaticContact CE2-CD2 3.55Å; Y155-Y159 HydrophobicContact CE2-CD2 3.55Å; Y155-Y159 AromaticContact CE2-CE2 3.82Å; Y155-Y159 HydrophobicContact CE2-CE2 3.82Å; Y155-Y159 HydrophobicContact CE2-CG 4.33Å; Y155-Y159 HydrophobicContact CG-CD2 4.11Å; Y155-Y159 AromaticContact CZ-CD2 3.95Å; Y155-Y159 PolarHBondContact O-N 3.23Å; Y155-R163 PolarHBondContact OH-NH1 2.88Å; Y155-R163 VanDerWaalsContact OH-NH1 3.07Å; Y155-M164 HydrophobicContact CD1-CB 4.05Å; Y155-M164 HydrophobicContact CD1-SD 4.24Å; Y155-M164 HydrophobicContact CE1-CB 4.36Å; Y155-M164 HydrophobicContact CG-SD 4Å
156	T	83.2	Confident	82.4	Confident	25 Å²	25	43.2 Å²	43.2	15%	0.153	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-38.2	179.9	-58.8	0	0	0	0	111.1	V152 R153 G160 G161 N162	V152-T156 VanDerWaalsContact O-CB 3.31Å; V152-T156 WeakPolarHBondContact O-CB 3.33Å; V152-T156 PolarHBondContact O-N 2.87Å; V152-T156 PolarHBondContact O-OG1 3.18Å; R153-T156 WeakPolarHBondContact O-CA 3.35Å; R153-T156 PolarHBondContact O-N 3.13Å; T156-G160 VanDerWaalsContact O-CA 3.26Å; T156-G160 WeakPolarHBondContact O-CA 3.38Å; T156-G160 PolarHBondContact O-N 3.06Å; T156-G161 PolarHBondContact O-N 2.85Å; T156-G161 VanDerWaalsContact O-N 3.15Å; T156-N162 PolarHBondContact OG1-ND2 3.13Å; T156-N162 VanDerWaalsContact OG1-ND2 3.09Å
157	D	82.3	Confident	82.6	Confident	117 Å²	117	39.9 Å²	39.9	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-71.2	-40.7	176.4	-66.3	-14.5	0	0	0	111.5	R153 Y155	R153-D157 PolarHBondContact O-N 2.86Å; Y155-D157 VanDerWaalsContact C-N 3.33Å
158	A	82.5	Confident	82.7	Confident	72 Å²	72	39.2 Å²	39.2	60%	0.595	22%	0.218	S	C	*	.	H	α-helix	trans	-74.6	-39.9	-178.2	0	0	0	0	0	114.2	D154 Y155	D154-A158 VanDerWaalsContact O-CB 3.23Å; D154-A158 WeakPolarHBondContact O-CB 3.38Å; D154-A158 PolarHBondContact O-N 2.99Å; Y155-A158 PolarHBondContact O-N 2.86Å
159	Y	77.7	Confident	82.8	Confident	147 Å²	147	39.2 Å²	39.2	58%	0.576	22%	0.218	S	C	*	.	H	α-helix	trans	-111.7	1.4	-173.4	-62.5	-82	0	0	0	114.2	Y155 R163	Y155-Y159 HydrophobicContact CD1-CD2 4.48Å; Y155-Y159 AromaticContact CD2-CD2 3.63Å; Y155-Y159 HydrophobicContact CD2-CD2 3.63Å; Y155-Y159 AromaticContact CD2-CE2 3.9Å; Y155-Y159 HydrophobicContact CD2-CE2 3.9Å; Y155-Y159 HydrophobicContact CE1-CD2 4.4Å; Y155-Y159 AromaticContact CE2-CD2 3.55Å; Y155-Y159 HydrophobicContact CE2-CD2 3.55Å; Y155-Y159 AromaticContact CE2-CE2 3.82Å; Y155-Y159 HydrophobicContact CE2-CE2 3.82Å; Y155-Y159 HydrophobicContact CE2-CG 4.33Å; Y155-Y159 HydrophobicContact CG-CD2 4.11Å; Y155-Y159 AromaticContact CZ-CD2 3.95Å; Y155-Y159 PolarHBondContact O-N 3.23Å; Y159-R163 VanDerWaalsContact C-NH2 3.27Å; Y159-R163 VanDerWaalsContact CB-NH1 3.26Å; Y159-R163 PolarHBondContact O-NH2 3.33Å
160	G	67.2	Low	82.8	Confident	58 Å²	58	39.2 Å²	39.2	60%	0.598	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.6	90.8	175.8	0	0	0	0	0	114.1	T156 R163	T156-G160 VanDerWaalsContact O-CA 3.26Å; T156-G160 WeakPolarHBondContact O-CA 3.38Å; T156-G160 PolarHBondContact O-N 3.06Å; G160-R163 PolarHBondContact O-NH2 2.84Å
161	G	62.7	Low	82.7	Confident	35 Å²	35	37.4 Å²	37.4	36%	0.361	21%	0.21	S	C	.	.	S	Bend	trans	82	144.3	165.1	0	0	0	0	0	115.9	T156 R163	T156-G161 PolarHBondContact O-N 2.85Å; T156-G161 VanDerWaalsContact O-N 3.15Å; G161-R163 PolarHBondContact O-N 3.26Å; G161-R163 VanDerWaalsContact O-N 3.07Å; G161-R163 PolarHBondContact O-NE 2.9Å; G161-R163 PolarHBondContact O-NH2 3.42Å
162	N	66.4	Low	82.5	Confident	70 Å²	70	37.8 Å²	37.8	37%	0.374	21%	0.211	S	C	.	.			trans	-65.1	104.2	-165.4	-58.7	83.2	0	0	0	114.4	T156 M164 M165	T156-N162 PolarHBondContact OG1-ND2 3.13Å; T156-N162 VanDerWaalsContact OG1-ND2 3.09Å; N162-M164 VanDerWaalsContact CB-O 3.32Å; N162-M164 WeakPolarHBondContact CB-O 3.39Å; N162-M164 PolarHBondContact ND2-O 2.98Å; N162-M165 HydrophobicContact CB-CG 3.81Å
163	R	72.8	Confident	82	Confident	91 Å²	91	39.3 Å²	39.3	34%	0.343	22%	0.219	S	C	.	.	S	Bend	trans	-81.5	-40.7	143	-73.4	126.6	-73	164	-18.5	110.4	Y155 Y159 G160 G161	Y155-R163 PolarHBondContact OH-NH1 2.88Å; Y155-R163 VanDerWaalsContact OH-NH1 3.07Å; Y159-R163 VanDerWaalsContact C-NH2 3.27Å; Y159-R163 VanDerWaalsContact CB-NH1 3.26Å; Y159-R163 PolarHBondContact O-NH2 3.33Å; G160-R163 PolarHBondContact O-NH2 2.84Å; G161-R163 PolarHBondContact O-N 3.26Å; G161-R163 VanDerWaalsContact O-N 3.07Å; G161-R163 PolarHBondContact O-NE 2.9Å; G161-R163 PolarHBondContact O-NH2 3.42Å
164	M	84.2	Confident	81.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-83.8	119.8	175.1	-166.7	-177.2	-175.2	0	0	108.7	L125 A129 I135 V152 Y155 N162	L125-M164 HydrophobicContact CB-CE 3.82Å; A129-M164 HydrophobicContact CB-CB 3.99Å; A129-M164 HydrophobicContact CB-CG 4Å; A129-M164 HydrophobicContact CB-SD 3.73Å; I135-M164 HydrophobicContact CD1-CE 3.23Å; I135-M164 HydrophobicContact CD1-CG 4Å; I135-M164 HydrophobicContact CD1-SD 4.42Å; V152-M164 HydrophobicContact CB-SD 4.42Å; V152-M164 HydrophobicContact CG2-CE 3.71Å; V152-M164 HydrophobicContact CG2-CG 4.05Å; V152-M164 HydrophobicContact CG2-SD 3.99Å; Y155-M164 HydrophobicContact CD1-CB 4.05Å; Y155-M164 HydrophobicContact CD1-SD 4.24Å; Y155-M164 HydrophobicContact CE1-CB 4.36Å; Y155-M164 HydrophobicContact CG-SD 4Å; N162-M164 VanDerWaalsContact CB-O 3.32Å; N162-M164 WeakPolarHBondContact CB-O 3.39Å; N162-M164 PolarHBondContact ND2-O 2.98Å
165	M	86.3	Confident	81.6	Confident	31 Å²	31	34.1 Å²	34.1	15%	0.153	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	141.3	178	-68.3	-174	-62.9	0	0	110.2	L97 W134 I135 N162 F167 N235 F236	L97-M165 HydrophobicContact CD2-CE 4.13Å; L97-M165 HydrophobicContact CD2-SD 4.09Å; W134-M165 HydrophobicContact CD2-CE 4.32Å; W134-M165 HydrophobicContact CG-CE 4.47Å; W134-M165 HydrophobicContact CZ2-CE 3.6Å; I135-M165 PolarHBondContact N-O 2.95Å; N162-M165 HydrophobicContact CB-CG 3.81Å; M165-F167 HydrophobicContact CB-CE2 4.44Å; M165-N235 WeakPolarHBondContact CA-OD1 3.3Å; M165-F236 HydrophobicContact SD-CE2 4.01Å
166	A	90.4	Very high	81.4	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.3	179.8	0	0	0	0	0	112.6	I135 V152 H234 N235 F236	I135-A166 CarbonylContact O-C 3.43Å; I135-A166 WeakPolarHBondContact O-CA 3.4Å; V152-A166 HydrophobicContact CG1-CB 4.49Å; V152-A166 HydrophobicContact CG2-CB 4.07Å; A166-H234 HydrophobicContact CB-CB 4.49Å; A166-N235 PolarHBondContact N-OD1 3.17Å; A166-N235 PolarHBondContact O-N 3.02Å; A166-F236 PolarHBondContact O-N 3.29Å
167	F	92.4	Very high	81.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.8	175	-68.2	-98.8	0	0	0	109.7	L91 W95 L97 W134 I135 V136 T137 M165 F236 F259	L91-F167 HydrophobicContact CD2-CE1 4.09Å; W95-F167 AromaticContact CE3-CE1 3.95Å; W95-F167 HydrophobicContact CE3-CE1 3.95Å; W95-F167 HydrophobicContact CZ3-CD1 4Å; W95-F167 AromaticContact CZ3-CE1 3.64Å; W95-F167 HydrophobicContact CZ3-CE1 3.64Å; L97-F167 HydrophobicContact CD1-CE1 4.01Å; L97-F167 HydrophobicContact CD1-CZ 3.66Å; W134-F167 HydrophobicContact CB-CE2 4.32Å; W134-F167 AromaticContact CD2-CE2 3.71Å; W134-F167 HydrophobicContact CD2-CE2 3.71Å; W134-F167 HydrophobicContact CD2-CZ 4.26Å; W134-F167 HydrophobicContact CE3-CD2 4.41Å; W134-F167 AromaticContact CE3-CE2 3.54Å; W134-F167 HydrophobicContact CE3-CE2 3.54Å; W134-F167 AromaticContact CE3-CZ 3.83Å; W134-F167 HydrophobicContact CE3-CZ 3.83Å; W134-F167 HydrophobicContact CG-CE2 4.07Å; W134-F167 HydrophobicContact CH2-CZ 4.25Å; W134-F167 HydrophobicContact CZ3-CE2 4.07Å; W134-F167 AromaticContact CZ3-CZ 3.85Å; W134-F167 HydrophobicContact CZ3-CZ 3.85Å; I135-F167 PolarHBondContact O-N 2.86Å; V136-F167 WeakPolarHBondContact CA-O 3.47Å; V136-F167 HydrophobicContact CG2-CB 4.45Å; T137-F167 PolarHBondContact N-O 2.9Å; M165-F167 HydrophobicContact CB-CE2 4.44Å; F167-F236 CarbonylContact C-O 3.56Å; F167-F236 WeakPolarHBondContact CA-O 3.47Å; F167-F236 HydrophobicContact CD1-CB 3.45Å; F167-F236 VanDerWaalsContact CD1-CB 3.45Å; F167-F236 HydrophobicContact CD1-CD2 4.09Å; F167-F236 AromaticContact CD1-CG 3.99Å; F167-F236 HydrophobicContact CD1-CG 3.99Å; F167-F236 HydrophobicContact CE1-CB 3.62Å; F167-F236 HydrophobicContact CE1-CD1 4.45Å; F167-F236 AromaticContact CE1-CD2 3.59Å; F167-F236 HydrophobicContact CE1-CD2 3.59Å; F167-F236 HydrophobicContact CE1-CE2 4.46Å; F167-F236 AromaticContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE2-CD2 4.11Å; F167-F236 HydrophobicContact CG-CB 4.17Å; F167-F236 HydrophobicContact CZ-CB 4.45Å; F167-F236 AromaticContact CZ-CD2 3.59Å; F167-F236 HydrophobicContact CZ-CD2 3.59Å; F167-F236 HydrophobicContact CZ-CE2 4.15Å; F167-F236 HydrophobicContact CZ-CG 4.11Å; F167-F259 HydrophobicContact CB-CE1 4.34Å; F167-F259 HydrophobicContact CD1-CE1 4.31Å; F167-F259 AromaticContact CD1-CZ 3.79Å; F167-F259 HydrophobicContact CD1-CZ 3.79Å; F167-F259 HydrophobicContact CE1-CZ 4.3Å; F167-F259 HydrophobicContact CG-CE1 4.42Å; F167-F259 HydrophobicContact CG-CZ 4.33Å
168	G	91.1	Very high	81.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.6	171.2	0	0	0	0	0	111.3	T137 F236 F237 V238	T137-G168 WeakPolarHBondContact O-CA 3.24Å; G168-F236 PolarHBondContact N-O 3.31Å; G168-F237 CarbonylContact O-C 3.58Å; G168-F237 WeakPolarHBondContact O-CA 3.31Å; G168-V238 PolarHBondContact O-N 2.84Å
169	V	90.8	Very high	81.4	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	104.1	172	-173.9	0	0	0	0	108.6	V136 T137 G138 V238 V240 L255 R256 F259	V136-V169 HydrophobicContact CG1-CG2 3.94Å; T137-V169 PolarHBondContact O-N 2.92Å; G138-V169 WeakPolarHBondContact CA-O 3.14Å; V169-V238 WeakPolarHBondContact CA-O 3.4Å; V169-V238 HydrophobicContact CG2-CB 4.29Å; V169-V240 HydrophobicContact CG1-CG2 4.29Å; V169-L255 HydrophobicContact CG1-CD2 4.37Å; V169-R256 HydrophobicContact CB-CB 4.47Å; V169-R256 HydrophobicContact CB-CG 4.41Å; V169-R256 HydrophobicContact CG1-CB 3.99Å; V169-R256 HydrophobicContact CG1-CG 4.46Å; V169-R256 HydrophobicContact CG2-CG 4.43Å; V169-F259 HydrophobicContact CG2-CD1 4.05Å; V169-F259 HydrophobicContact CG2-CE1 4.29Å
170	A	87.6	Confident	81.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	150.1	-171.8	0	0	0	0	0	111.6	G138 F140 L230 V238 L239 V240	G138-A170 WeakPolarHBondContact O-CB 3.45Å; F140-A170 HydrophobicContact CE1-CB 4.09Å; F140-A170 HydrophobicContact CE2-CB 3.88Å; F140-A170 HydrophobicContact CZ-CB 3.58Å; A170-L230 HydrophobicContact CB-CD2 4.4Å; A170-V238 PolarHBondContact N-O 3.06Å; A170-L239 HydrophobicContact CB-CD2 3.95Å; A170-L239 CarbonylContact O-C 3.59Å; A170-L239 WeakPolarHBondContact O-CA 3.32Å; A170-V240 PolarHBondContact O-N 3.02Å
171	S	84.9	Confident	82.4	Confident	4 Å²	4	30.4 Å²	30.4	3%	0.028	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	128.9	169.2	-178.3	0	0	0	0	110	D173 C174	S171-D173 VanDerWaalsContact C-N 3.27Å; S171-D173 PolarHBondContact O-N 2.76Å; S171-C174 PolarHBondContact O-N 3.29Å; S171-C174 VanDerWaalsContact O-N 3.15Å
172	W	84.5	Confident	83.4	Confident	9 Å²	9	33.2 Å²	33.2	3%	0.034	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-58.2	-37.1	-176.6	174	-95.6	0	0	0	112.8	K77 C174 V175 N178 L181 E182 L239 V240 D241	K77-W172 HydrophobicContact CD-CD2 4.06Å; K77-W172 HydrophobicContact CD-CE3 4.04Å; K77-W172 HydrophobicContact CD-CH2 4.3Å; K77-W172 HydrophobicContact CD-CZ2 4.33Å; K77-W172 HydrophobicContact CD-CZ3 4.16Å; K77-W172 HydrophobicContact CG-CE3 4.27Å; W172-C174 VanDerWaalsContact C-N 3.25Å; W172-C174 PolarHBondContact O-N 2.89Å; W172-V175 PolarHBondContact O-N 2.93Å; W172-N178 HydrophobicContact CH2-CB 4.4Å; W172-N178 WeakPolarHBondContact CH2-O 3.34Å; W172-N178 HydrophobicContact CZ2-CB 3.95Å; W172-N178 WeakPolarHBondContact CZ2-O 3.45Å; W172-L181 HydrophobicContact CH2-CB 3.61Å; W172-L181 HydrophobicContact CZ3-CB 3.8Å; W172-L181 HydrophobicContact CZ3-CD1 4.35Å; W172-E182 HydrophobicContact CH2-CB 4.22Å; W172-E182 HydrophobicContact CZ2-CB 4.01Å; W172-L239 HydrophobicContact CE3-CB 3.86Å; W172-L239 HydrophobicContact CE3-CD1 3.6Å; W172-L239 HydrophobicContact CE3-CG 4.36Å; W172-L239 HydrophobicContact CZ3-CD1 3.59Å; W172-V240 VanDerWaalsContact CB-O 3.27Å; W172-V240 WeakPolarHBondContact CB-O 3.31Å; W172-V240 PolarHBondContact N-O 2.91Å; W172-D241 HydrophobicContact CB-CB 4.18Å; W172-D241 HydrophobicContact CG-CB 4.42Å
173	D	77.4	Confident	84	Confident	34 Å²	34	32.9 Å²	32.9	18%	0.182	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-77.3	-10.5	-177.4	-65.5	-33.9	0	0	0	113.4	S171 L248	S171-D173 VanDerWaalsContact C-N 3.27Å; S171-D173 PolarHBondContact O-N 2.76Å; D173-L248 HydrophobicContact CB-CD1 3.96Å; D173-L248 HydrophobicContact CB-CD2 4.05Å; D173-L248 WeakPolarHBondContact OD2-CD2 3.17Å
174	C	79.6	Confident	84.3	Confident	9 Å²	9	28.6 Å²	28.6	6%	0.061	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-96.2	-5.1	176.3	-63.5	0	0	0	0	113	F140 S171 W172 R228	F140-C174 HydrophobicContact CE1-CB 4.24Å; F140-C174 HydrophobicContact CZ-CB 3.77Å; S171-C174 PolarHBondContact O-N 3.29Å; S171-C174 VanDerWaalsContact O-N 3.15Å; W172-C174 VanDerWaalsContact C-N 3.25Å; W172-C174 PolarHBondContact O-N 2.89Å; C174-R228 PolarHBondContact O-N 2.79Å
175	V	83.4	Confident	83.9	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.012	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-83.6	123.5	-177.5	176.5	0	0	0	0	110.4	F140 W172 N178 L181 Y192 R228 L230 L239	F140-V175 HydrophobicContact CE1-CG2 4.09Å; W172-V175 PolarHBondContact O-N 2.93Å; V175-N178 HydrophobicContact CB-CB 4.44Å; V175-L181 HydrophobicContact CG1-CD1 3.74Å; V175-Y192 HydrophobicContact CG1-CE2 4.48Å; V175-R228 WeakPolarHBondContact CA-O 3.35Å; V175-L230 HydrophobicContact CG1-CD1 3.97Å; V175-L230 HydrophobicContact CG1-CD2 4.33Å; V175-L230 HydrophobicContact CG1-CG 3.84Å; V175-L230 HydrophobicContact CG2-CD2 3.94Å; V175-L230 HydrophobicContact CG2-CG 4.37Å; V175-L239 HydrophobicContact CG2-CD2 4.23Å
176	T	82.8	Confident	83.1	Confident	30 Å²	30	33.8 Å²	33.8	18%	0.184	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	143.6	173	53.3	0	0	0	0	110.5	N178 Y192 E227 R228 A229	T176-N178 PolarHBondContact O-N 3.1Å; T176-Y192 VanDerWaalsContact O-CE2 3.22Å; T176-Y192 WeakPolarHBondContact O-CE2 3.32Å; T176-Y192 PolarHBondContact O-OH 3.13Å; T176-Y192 PolarHBondContact OG1-OH 2.84Å; T176-E227 HydrophobicContact CG2-CB 3.53Å; T176-R228 PolarHBondContact N-O 2.8Å; T176-A229 WeakPolarHBondContact OG1-CA 3.31Å
177	K	82.7	Confident	82	Confident	79 Å²	79	42.2 Å²	42.2	34%	0.343	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	35.8	178.2	-54.6	177.1	-177.5	171.6	0	113.5	E179 I180 Y192 E195	K177-E179 PolarHBondContact O-N 3.23Å; K177-I180 HydrophobicContact CB-CD1 3.81Å; K177-I180 HydrophobicContact CB-CG1 4.21Å; K177-I180 HydrophobicContact CD-CD1 3.95Å; K177-I180 HydrophobicContact CG-CD1 4.39Å; K177-I180 WeakPolarHBondContact O-CB 3.48Å; K177-I180 PolarHBondContact O-N 3.45Å; K177-Y192 HydrophobicContact CB-CE2 4.29Å; K177-E195 IonicContact NZ-OE2 2.7Å; K177-E195 PolarHBondContact NZ-OE2 2.9Å
178	N	81.9	Confident	81	Confident	39 Å²	39	43.6 Å²	43.6	21%	0.209	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-22.3	179.6	67.1	-4	0	0	0	114.1	W172 V175 T176 I180 L181 E182	W172-N178 HydrophobicContact CH2-CB 4.4Å; W172-N178 WeakPolarHBondContact CH2-O 3.34Å; W172-N178 HydrophobicContact CZ2-CB 3.95Å; W172-N178 WeakPolarHBondContact CZ2-O 3.45Å; V175-N178 HydrophobicContact CB-CB 4.44Å; T176-N178 PolarHBondContact O-N 3.1Å; N178-I180 VanDerWaalsContact C-N 3.26Å; N178-I180 PolarHBondContact O-N 3.13Å; N178-L181 PolarHBondContact O-N 3.09Å; N178-L181 VanDerWaalsContact O-N 3.14Å; N178-E182 PolarHBondContact O-N 3.24Å
179	E	83	Confident	80.4	Confident	144 Å²	144	48.2 Å²	48.2	67%	0.673	26%	0.257	S	S	*	.	H	α-helix	trans	-56.1	-36.4	172.3	-57	-177.3	-179	0	0	112.8	K177 E182 A183	K177-E179 PolarHBondContact O-N 3.23Å; E179-E182 PolarHBondContact O-N 3.32Å; E179-A183 PolarHBondContact O-N 2.95Å; E179-A183 VanDerWaalsContact O-N 3.09Å
180	I	83.5	Confident	79.8	Confident	60 Å²	60	48.2 Å²	48.2	31%	0.308	26%	0.257	S	S	.	.	H	α-helix	trans	-68.9	-41.1	178.1	-56.6	177.8	0	0	0	110.3	K177 N178 E182 A183 A184 A190 V191	K177-I180 HydrophobicContact CB-CD1 3.81Å; K177-I180 HydrophobicContact CB-CG1 4.21Å; K177-I180 HydrophobicContact CD-CD1 3.95Å; K177-I180 HydrophobicContact CG-CD1 4.39Å; K177-I180 WeakPolarHBondContact O-CB 3.48Å; K177-I180 PolarHBondContact O-N 3.45Å; N178-I180 VanDerWaalsContact C-N 3.26Å; N178-I180 PolarHBondContact O-N 3.13Å; I180-E182 VanDerWaalsContact C-N 3.3Å; I180-A183 PolarHBondContact O-N 3.41Å; I180-A184 PolarHBondContact O-N 3.08Å; I180-A184 VanDerWaalsContact O-N 3.14Å; I180-A190 HydrophobicContact CG2-CB 3.97Å; I180-V191 WeakPolarHBondContact CG2-O 3.44Å
181	L	83	Confident	79.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69	-32.3	176.6	-59.2	179.6	0	0	0	111.1	I64 F75 W172 V175 N178 A184 L185 A190 Y192 L230 L239	I64-L181 HydrophobicContact CD1-CD2 3.69Å; I64-L181 HydrophobicContact CG1-CD2 3.83Å; F75-L181 HydrophobicContact CE1-CD2 4.43Å; F75-L181 HydrophobicContact CE2-CB 4.18Å; F75-L181 HydrophobicContact CZ-CB 4.22Å; F75-L181 HydrophobicContact CZ-CD2 4.4Å; F75-L181 WeakPolarHBondContact CZ-O 3.47Å; W172-L181 HydrophobicContact CH2-CB 3.61Å; W172-L181 HydrophobicContact CZ3-CB 3.8Å; W172-L181 HydrophobicContact CZ3-CD1 4.35Å; V175-L181 HydrophobicContact CG1-CD1 3.74Å; N178-L181 PolarHBondContact O-N 3.09Å; N178-L181 VanDerWaalsContact O-N 3.14Å; L181-A184 PolarHBondContact O-N 3Å; L181-L185 PolarHBondContact O-N 3.44Å; L181-A190 HydrophobicContact CD2-CB 3.81Å; L181-Y192 HydrophobicContact CD1-CE2 4.47Å; L181-Y192 HydrophobicContact CD2-CD2 4.12Å; L181-Y192 HydrophobicContact CG-CD2 4.33Å; L181-Y192 HydrophobicContact CG-CE2 4.5Å; L181-L230 HydrophobicContact CD1-CD1 3.85Å; L181-L239 HydrophobicContact CD1-CD1 3.94Å
182	E	82.8	Confident	79.4	Confident	95 Å²	95	52 Å²	52	44%	0.444	28%	0.28	S	S	.	.	H	α-helix	trans	-66.4	-39	175.2	-165.7	164.8	-165.9	0	0	111.5	W172 N178 E179 I180 A184 L185	W172-E182 HydrophobicContact CH2-CB 4.22Å; W172-E182 HydrophobicContact CZ2-CB 4.01Å; N178-E182 PolarHBondContact O-N 3.24Å; E179-E182 PolarHBondContact O-N 3.32Å; I180-E182 VanDerWaalsContact C-N 3.3Å; E182-A184 VanDerWaalsContact C-N 3.33Å; E182-A184 PolarHBondContact O-N 3.42Å; E182-L185 PolarHBondContact O-N 3.1Å
183	A	78.5	Confident	79	Confident	62 Å²	62	55.8 Å²	55.8	51%	0.512	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-37.8	172.6	0	0	0	0	0	112.3	E179 I180 L185 H186 E187	E179-A183 PolarHBondContact O-N 2.95Å; E179-A183 VanDerWaalsContact O-N 3.09Å; I180-A183 PolarHBondContact O-N 3.41Å; A183-L185 VanDerWaalsContact C-N 3.31Å; A183-L185 PolarHBondContact O-N 3.25Å; A183-H186 WeakPolarHBondContact O-CB 3.25Å; A183-H186 PolarHBondContact O-N 2.98Å; A183-E187 PolarHBondContact O-N 2.91Å
184	A	78.5	Confident	78.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-70.6	-22.7	179.1	0	0	0	0	0	114.5	F75 I180 L181 E182 H186 G188 A190	F75-A184 HydrophobicContact CE1-CB 4.08Å; F75-A184 HydrophobicContact CZ-CB 3.94Å; I180-A184 PolarHBondContact O-N 3.08Å; I180-A184 VanDerWaalsContact O-N 3.14Å; L181-A184 PolarHBondContact O-N 3Å; E182-A184 VanDerWaalsContact C-N 3.33Å; E182-A184 PolarHBondContact O-N 3.42Å; A184-H186 PolarHBondContact O-N 3.12Å; A184-G188 CarbonylContact O-C 3.2Å; A184-G188 WeakPolarHBondContact O-CA 3.49Å; A184-G188 PolarHBondContact O-N 2.93Å; A184-A190 HydrophobicContact CB-CB 3.35Å; A184-A190 VanDerWaalsContact CB-N 3.29Å
185	L	76	Confident	77.5	Confident	19 Å²	19	60.4 Å²	60.4	10%	0.099	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-19.4	169.6	-68.6	170.3	0	0	0	112.5	F75 K77 L181 E182 A183	F75-L185 HydrophobicContact CE2-CD2 3.75Å; F75-L185 HydrophobicContact CE2-CG 4.01Å; F75-L185 HydrophobicContact CZ-CD2 4.13Å; F75-L185 HydrophobicContact CZ-CG 4.21Å; K77-L185 HydrophobicContact CB-CD1 3.94Å; K77-L185 HydrophobicContact CB-CD2 4.18Å; K77-L185 HydrophobicContact CD-CD1 3.64Å; K77-L185 HydrophobicContact CG-CD1 4.4Å; L181-L185 PolarHBondContact O-N 3.44Å; E182-L185 PolarHBondContact O-N 3.1Å; A183-L185 VanDerWaalsContact C-N 3.31Å; A183-L185 PolarHBondContact O-N 3.25Å
186	H	69.7	Low	76.1	Confident	121 Å²	121	66.6 Å²	66.6	56%	0.56	35%	0.35	S	S	*	.	H	α-helix	trans	-98.1	-54.8	-178.6	-76.2	-67.6	0	0	0	113.5	A183 A184	A183-H186 WeakPolarHBondContact O-CB 3.25Å; A183-H186 PolarHBondContact O-N 2.98Å; A184-H186 PolarHBondContact O-N 3.12Å
187	E	68.3	Low	74.1	Confident	177 Å²	177	72.8 Å²	72.8	83%	0.827	38%	0.382	S	S	*	.	H	α-helix	trans	-98.7	-3.4	-177.4	-51.7	-52.4	123.7	0	0	113.3	A183	A183-E187 PolarHBondContact O-N 2.91Å
188	G	70.3	Confident	71.9	Confident	30 Å²	30	78.3 Å²	78.3	31%	0.309	41%	0.409	S	S	.	.	S	Bend	trans	113.2	-32.7	163.1	0	0	0	0	0	116	G62 E63 A184	G62-G188 WeakPolarHBondContact CA-O 3.2Å; E63-G188 PolarHBondContact N-O 2.84Å; A184-G188 CarbonylContact O-C 3.2Å; A184-G188 WeakPolarHBondContact O-CA 3.49Å; A184-G188 PolarHBondContact O-N 2.93Å
189	T	79	Confident	69.8	Low	96 Å²	96	85.7 Å²	85.7	59%	0.589	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.8	-168.6	52.3	0	0	0	0	112.5	E63	E63-T189 CarbonylContact O-C 3.52Å; E63-T189 WeakPolarHBondContact O-CA 3.37Å
190	A	78.1	Confident	67.7	Low	2 Å²	2	88.1 Å²	88.1	2%	0.017	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.6	172.5	0	0	0	0	0	109.8	E63 I64 E65 I180 L181 A184	E63-A190 PolarHBondContact O-N 3.43Å; I64-A190 CarbonylContact C-O 3.55Å; I64-A190 WeakPolarHBondContact CA-O 3.49Å; E65-A190 PolarHBondContact N-O 3.44Å; I180-A190 HydrophobicContact CG2-CB 3.97Å; L181-A190 HydrophobicContact CD2-CB 3.81Å; A184-A190 HydrophobicContact CB-CB 3.35Å; A184-A190 VanDerWaalsContact CB-N 3.29Å
191	V	82.4	Confident	65.3	Low	84 Å²	84	94.8 Å²	94.8	51%	0.509	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	110.8	163.1	178.9	0	0	0	0	106.8	E65 T67 I180	E65-V191 WeakPolarHBondContact O-CA 3.38Å; T67-V191 HydrophobicContact CG2-CG1 3.19Å; I180-V191 WeakPolarHBondContact CG2-O 3.44Å
192	Y	83.1	Confident	63	Low	0 Å²	0	99.4 Å²	99.4	0%	0	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	123.2	-174.1	-171.1	-94.3	0	0	0	110.6	I64 E65 F66 T67 V175 T176 K177 L181 L230	I64-Y192 VanDerWaalsContact CG2-CB 3.45Å; I64-Y192 HydrophobicContact CG2-CG 4.23Å; E65-Y192 PolarHBondContact O-N 3.16Å; F66-Y192 WeakPolarHBondContact CA-O 3.31Å; F66-Y192 AromaticContact CD1-CD1 3.85Å; F66-Y192 HydrophobicContact CD1-CD1 3.85Å; F66-Y192 AromaticContact CE1-CD1 3.59Å; F66-Y192 HydrophobicContact CE1-CD1 3.59Å; F66-Y192 HydrophobicContact CE1-CE1 4.14Å; F66-Y192 HydrophobicContact CE1-CG 4.5Å; T67-Y192 PolarHBondContact N-O 3.04Å; T67-Y192 VanDerWaalsContact N-O 3.16Å; V175-Y192 HydrophobicContact CG1-CE2 4.48Å; T176-Y192 VanDerWaalsContact O-CE2 3.22Å; T176-Y192 WeakPolarHBondContact O-CE2 3.32Å; T176-Y192 PolarHBondContact O-OH 3.13Å; T176-Y192 PolarHBondContact OG1-OH 2.84Å; K177-Y192 HydrophobicContact CB-CE2 4.29Å; L181-Y192 HydrophobicContact CD1-CE2 4.47Å; L181-Y192 HydrophobicContact CD2-CD2 4.12Å; L181-Y192 HydrophobicContact CG-CD2 4.33Å; L181-Y192 HydrophobicContact CG-CE2 4.5Å; Y192-L230 HydrophobicContact CE1-CB 4.03Å; Y192-L230 PolarHBondContact OH-N 2.96Å
193	Q	75.2	Confident	60.8	Low	87 Å²	87	104 Å²	104	41%	0.407	54%	0.543	S	S	.	.			trans	-96.4	102.8	175.4	-90.4	171.4	-26.7	0	0	108.9	T67 E195	T67-Q193 HydrophobicContact CG2-CG 3.89Å; T67-Q193 WeakPolarHBondContact OG1-CG 3.38Å; Q193-E195 VanDerWaalsContact CB-CD 3.46Å; Q193-E195 HydrophobicContact CB-CG 3.93Å; Q193-E195 WeakPolarHBondContact CB-OE1 3.47Å; Q193-E195 HydrophobicContact CG-CG 4.47Å; Q193-E195 WeakPolarHBondContact CG-OE1 3.49Å; Q193-E195 PolarHBondContact NE2-OE1 2.93Å; Q193-E195 PolarHBondContact O-N 3.41Å; Q193-E195 PolarHBondContact OE1-OE1 3.21Å
194	S	67.9	Low	58.8	Low	36 Å²	36	108.5 Å²	108.5	25%	0.252	56%	0.559	S	S	.	*			trans	-81.3	102	164.4	53.1	0	0	0	0	107.9
195	E	58.6	Low	56.7	Low	105 Å²	105	114.2 Å²	114.2	49%	0.491	60%	0.599	S	S	.	*			trans	-128.4	130	-171.6	-70.3	161.6	158.6	0	0	109.7	K177 Q193	K177-E195 IonicContact NZ-OE2 2.7Å; K177-E195 PolarHBondContact NZ-OE2 2.9Å; Q193-E195 VanDerWaalsContact CB-CD 3.46Å; Q193-E195 HydrophobicContact CB-CG 3.93Å; Q193-E195 WeakPolarHBondContact CB-OE1 3.47Å; Q193-E195 HydrophobicContact CG-CG 4.47Å; Q193-E195 WeakPolarHBondContact CG-OE1 3.49Å; Q193-E195 PolarHBondContact NE2-OE1 2.93Å; Q193-E195 PolarHBondContact O-N 3.41Å; Q193-E195 PolarHBondContact OE1-OE1 3.21Å
196	E	53.2	Low	54.5	Low	131 Å²	131	122.2 Å²	122.2	61%	0.612	64%	0.635	S	S	*	*			trans	-135.4	16.9	168.2	-73.2	-178.5	167.3	0	0	111.4
197	D	39.8	Very low	52.7	Low	161 Å²	161	121.1 Å²	121.1	86%	0.861	64%	0.639	S	S	*	*			trans	-96.2	20.8	-166.3	-64.1	-28.4	0	0	0	116.1
198	E	36.8	Very low	50.8	Low	195 Å²	195	119.4 Å²	119.4	91%	0.911	63%	0.634	S	S	*	*			trans	-99.9	10.5	-177.6	-77.7	-163.9	172.9	0	0	116.7
199	E	39.2	Very low	48.8	Very low	194 Å²	194	126.3 Å²	126.3	91%	0.907	66%	0.663	S	S	*	*	S	Bend	trans	-101	8.6	-175.8	-72.7	-169.7	168.5	0	0	117.3
200	E	38	Very low	46.6	Very low	195 Å²	195	127 Å²	127	91%	0.911	67%	0.667	S	S	*	*	S	Bend	trans	-98.1	-1.1	-178.4	-91.1	-172.1	167.6	0	0	117.5
201	E	33.2	Very low	44.5	Very low	199 Å²	199	134.6 Å²	134.6	93%	0.93	71%	0.707	S	S	*	*	S	Bend	trans	-118	11.9	-171.6	-82.7	-165.6	164.7	0	0	118.1
202	A	34	Very low	42.1	Very low	97 Å²	97	135.8 Å²	135.8	80%	0.802	72%	0.717	S	S	*	*			trans	-114.5	21.1	-173.1	0	0	0	0	0	117	D204	A202-D204 PolarHBondContact O-N 3.48Å
203	E	37.3	Very low	39.4	Very low	192 Å²	192	143.8 Å²	143.8	90%	0.897	76%	0.759	S	S	*	*			trans	-79.6	-2.1	-176.6	-77.3	-163.8	148.3	0	0	116.7
204	D	35.7	Very low	37.3	Very low	156 Å²	156	145 Å²	145	83%	0.834	78%	0.777	S	S	*	*	S	Bend	trans	-126.5	72.5	-172.7	-79.6	-36.8	0	0	0	114	A202	A202-D204 PolarHBondContact O-N 3.48Å
205	S	35.9	Very low	35.6	Very low	121 Å²	121	152.7 Å²	152.7	85%	0.846	81%	0.809	S	S	*	*			trans	-175.6	108.8	152.2	19.4	0	0	0	0	114.9
206	E	28.3	Very low	34.1	Very low	187 Å²	187	151.9 Å²	151.9	87%	0.874	83%	0.828	S	S	*	*			trans	-73.2	167.8	159.1	-85.8	-166.3	157.5	0	0	111.7
207	P	32.5	Very low	32.9	Very low	98 Å²	98	148.7 Å²	148.7	64%	0.636	83%	0.831	S	S	*	*			cis	-136	-153.7	-42	39.2	-22.1	0	0	0	110.4
208	I	29.4	Very low	32.4	Very low	141 Å²	141	149.6 Å²	149.6	72%	0.723	83%	0.834	S	S	*	*				155.1	124.6	130	-73.4	153.5	0	0	0	110.5	V210	I208-V210 HydrophobicContact CG2-CG2 3.67Å; I208-V210 PolarHBondContact O-N 3.2Å
209	L	28	Very low	32	Very low	176 Å²	176	149.7 Å²	149.7	92%	0.921	83%	0.831	S	S	*	*			trans	-75.9	108.3	176.1	-158	122	0	0	0	110.3
210	V	32.8	Very low	31.6	Very low	110 Å²	110	145.6 Å²	145.6	67%	0.667	82%	0.824	S	S	*	*			trans	-138.8	108.3	169.5	-164	0	0	0	0	110	I208	I208-V210 HydrophobicContact CG2-CG2 3.67Å; I208-V210 PolarHBondContact O-N 3.2Å
211	D	32.4	Very low	31.2	Very low	162 Å²	162	142.4 Å²	142.4	87%	0.866	82%	0.817	S	S	*	*			trans	-67.5	126.2	155.2	-91.3	-33.3	0	0	0	108.2
212	P	32.2	Very low	31.2	Very low	109 Å²	109	143 Å²	143	71%	0.708	81%	0.811	S	S	*	*				-154.1	136.8	114.8	30.4	-8.5	0	0	0	116.1
213	L	27.5	Very low	31.2	Very low	167 Å²	167	142.6 Å²	142.6	87%	0.874	80%	0.802	S	S	*	*			trans	-38.2	150.8	145.2	-72	140.3	0	0	0	114.3
214	S	30.3	Very low	31.7	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	80%	0.796	S	S	*	*			trans	98.6	89.7	153.5	80.7	0	0	0	0	119.1
215	Q	32.2	Very low	32.6	Very low	198 Å²	198	136.2 Å²	136.2	93%	0.925	77%	0.774	S	S	*	*				177	93.3	128.2	-94.5	171.8	40.4	0	0	105.1
216	G	26.6	Very low	33.8	Very low	88 Å²	88	135.7 Å²	135.7	91%	0.907	76%	0.758	S	S	*	*				104.5	62.5	72.8	0	0	0	0	0	109.6
217	G	28.9	Very low	35.8	Very low	64 Å²	64	131.9 Å²	131.9	66%	0.66	74%	0.74	S	S	*	*			trans	174.1	80.3	-179.2	0	0	0	0	0	110.9	K219	G217-K219 VanDerWaalsContact C-N 3.34Å; G217-K219 PolarHBondContact O-N 3.36Å
218	I	28.5	Very low	37.9	Very low	181 Å²	181	129.8 Å²	129.8	93%	0.928	72%	0.719	S	S	*	*			trans	-66.2	87.8	-176.6	-58.5	169.1	0	0	0	108.9
219	K	28.9	Very low	40.6	Very low	197 Å²	197	123.4 Å²	123.4	86%	0.857	69%	0.688	S	S	*	*			trans	-85.4	116.8	163.9	-73.4	-175.9	177	-178.4	0	107.2	G217 V221	G217-K219 VanDerWaalsContact C-N 3.34Å; G217-K219 PolarHBondContact O-N 3.36Å; K219-V221 PolarHBondContact O-N 3.22Å
220	S	31	Very low	43.5	Very low	107 Å²	107	115 Å²	115	75%	0.748	64%	0.644	S	S	*	*			trans	-64.3	119.7	-173.1	62.3	0	0	0	0	111.3	R222	S220-R222 PolarHBondContact O-N 2.9Å; S220-R222 VanDerWaalsContact O-N 3.16Å
221	V	29.8	Very low	46.1	Very low	128 Å²	128	109.8 Å²	109.8	78%	0.776	61%	0.612	S	S	*	*			trans	-50.8	111.3	176.4	177.9	0	0	0	0	110.7	K219	K219-V221 PolarHBondContact O-N 3.22Å
222	R	32.5	Very low	48.7	Very low	212 Å²	212	102.4 Å²	102.4	80%	0.8	57%	0.573	S	S	*	*			trans	-88.1	100	161.4	-82.5	177.3	168.6	163.3	-5.3	106	S220	S220-R222 PolarHBondContact O-N 2.9Å; S220-R222 VanDerWaalsContact O-N 3.16Å
223	S	35.2	Very low	51.3	Low	88 Å²	88	97.5 Å²	97.5	62%	0.615	54%	0.541	S	S	*	.			trans	-115.1	-2.4	-177.6	53.9	0	0	0	0	115.3
224	D	46.2	Very low	54.3	Low	145 Å²	145	89.7 Å²	89.7	78%	0.775	50%	0.5	S	S	*	.	S	Bend	trans	-124.6	12.4	-165.5	-52.5	-5.4	0	0	0	113.8
225	I	54.7	Low	57	Low	69 Å²	69	86 Å²	86	35%	0.354	47%	0.472	S	S	.	.			trans	-120	100.1	179.3	-54.3	173.5	0	0	0	108.6	E227 L248	I225-E227 PolarHBondContact O-N 3.09Å; I225-E227 VanDerWaalsContact O-N 3.15Å; I225-L248 HydrophobicContact CD1-CD1 4.13Å
226	E	61.8	Low	59.9	Low	111 Å²	111	77.5 Å²	77.5	52%	0.519	43%	0.432	S	S	.	.			trans	-74.4	98	171.9	-170.6	-170.9	-144.7	0	0	108.4	R228 K249	E226-R228 IonicContact OE2-CZ 3.65Å; E226-R228 IonicContact OE2-NE 3Å; E226-R228 PolarHBondContact OE2-NE 3.16Å; E226-R228 IonicContact OE2-NH2 3.88Å; E226-R228 PolarHBondContact OE2-NH2 3.21Å; E226-K249 IonicContact OE2-NZ 2.72Å; E226-K249 PolarHBondContact OE2-NZ 3.06Å
227	E	69.5	Low	63	Low	107 Å²	107	73.3 Å²	73.3	50%	0.5	39%	0.389	S	S	.	.			trans	-67.8	138.7	175.3	-59.1	-176.8	-175.1	0	0	109.9	T176 I225	T176-E227 HydrophobicContact CG2-CB 3.53Å; I225-E227 PolarHBondContact O-N 3.09Å; I225-E227 VanDerWaalsContact O-N 3.15Å
228	R	78.6	Confident	65.9	Low	53 Å²	53	70.3 Å²	70.3	20%	0.2	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-127.8	140.4	-178.7	-63.4	178	-176.4	171.7	-2.7	111.4	F140 C174 V175 T176 E226	F140-R228 HydrophobicContact CB-CB 4.38Å; F140-R228 HydrophobicContact CD1-CB 3.52Å; F140-R228 HydrophobicContact CE1-CB 3.96Å; F140-R228 HydrophobicContact CG-CB 4.05Å; C174-R228 PolarHBondContact O-N 2.79Å; V175-R228 WeakPolarHBondContact CA-O 3.35Å; T176-R228 PolarHBondContact N-O 2.8Å; E226-R228 IonicContact OE2-CZ 3.65Å; E226-R228 IonicContact OE2-NE 3Å; E226-R228 PolarHBondContact OE2-NE 3.16Å; E226-R228 IonicContact OE2-NH2 3.88Å; E226-R228 PolarHBondContact OE2-NH2 3.21Å
229	A	85.2	Confident	68.8	Low	8 Å²	8	61.7 Å²	61.7	7%	0.066	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-73.3	146	176.8	0	0	0	0	0	112.4	F140 H141 T176	F140-A229 CarbonylContact C-O 3.58Å; F140-A229 WeakPolarHBondContact CA-O 3.48Å; H141-A229 PolarHBondContact N-O 3.39Å; T176-A229 WeakPolarHBondContact OG1-CA 3.31Å
230	L	88.5	Confident	71.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-72.2	141.9	170.3	-66.9	176.4	0	0	0	111	I64 F66 A170 V175 L181 Y192 F237 L239	I64-L230 HydrophobicContact CD1-CD1 3.85Å; F66-L230 HydrophobicContact CE1-CB 4.26Å; F66-L230 HydrophobicContact CZ-CB 4.29Å; A170-L230 HydrophobicContact CB-CD2 4.4Å; V175-L230 HydrophobicContact CG1-CD1 3.97Å; V175-L230 HydrophobicContact CG1-CD2 4.33Å; V175-L230 HydrophobicContact CG1-CG 3.84Å; V175-L230 HydrophobicContact CG2-CD2 3.94Å; V175-L230 HydrophobicContact CG2-CG 4.37Å; L181-L230 HydrophobicContact CD1-CD1 3.85Å; Y192-L230 HydrophobicContact CE1-CB 4.03Å; Y192-L230 PolarHBondContact OH-N 2.96Å; L230-F237 HydrophobicContact CB-CE1 4.14Å; L230-F237 HydrophobicContact CB-CZ 4.12Å; L230-F237 HydrophobicContact CD1-CD1 4.49Å; L230-F237 HydrophobicContact CD2-CD1 3.96Å; L230-F237 HydrophobicContact CD2-CE1 3.88Å; L230-F237 HydrophobicContact CG-CE1 4.41Å; L230-L239 HydrophobicContact CD2-CD2 4.33Å
231	D	88.5	Confident	73.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-78.1	124.7	-179.4	-179.9	74.6	0	0	0	112.4	G139 H141 N233 H234 F237	G139-D231 PolarHBondContact O-N 3.07Å; H141-D231 HydrophobicContact CB-CB 4.27Å; H141-D231 IonicContact CE1-OD1 2.85Å; H141-D231 IonicContact CG-OD1 3.61Å; H141-D231 IonicContact ND1-OD1 3.45Å; H141-D231 PolarHBondContact ND1-OD1 2.82Å; D231-N233 PolarHBondContact O-N 2.98Å; D231-N233 VanDerWaalsContact O-N 3.13Å; D231-N233 PolarHBondContact OD1-ND2 3.15Å; D231-N233 WeakPolarHBondContact OD2-CA 3.41Å; D231-N233 VanDerWaalsContact OD2-CB 3.3Å; D231-N233 WeakPolarHBondContact OD2-CB 3.3Å; D231-N233 PolarHBondContact OD2-N 3.13Å; D231-N233 PolarHBondContact OD2-ND2 3.48Å; D231-H234 PolarHBondContact O-N 3.33Å; D231-H234 IonicContact OD2-CE1 2.76Å; D231-H234 IonicContact OD2-ND1 2.76Å; D231-H234 PolarHBondContact OD2-ND1 3.4Å; D231-F237 WeakPolarHBondContact O-CZ 3.37Å
232	P	86.1	Confident	75.6	Confident	6 Å²	6	44.9 Å²	44.9	4%	0.039	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-15.7	-175.2	26.2	-34.9	0	0	0	114.5	F66 L69 Q71 H234	F66-P232 HydrophobicContact CB-CB 4.11Å; F66-P232 HydrophobicContact CD1-CB 3.83Å; F66-P232 HydrophobicContact CD2-CB 4.19Å; F66-P232 HydrophobicContact CE1-CB 4.26Å; F66-P232 HydrophobicContact CG-CB 3.79Å; L69-P232 HydrophobicContact CD1-CB 3.56Å; L69-P232 HydrophobicContact CD1-CG 3.42Å; L69-P232 VanDerWaalsContact CD1-CG 3.42Å; Q71-P232 PolarHBondContact OE1-O 3.4Å; Q71-P232 VanDerWaalsContact OE1-O 3.06Å; P232-H234 VanDerWaalsContact C-N 3.35Å
233	N	87.5	Confident	76.9	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.032	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	2.5	-175.1	-46.1	-73.8	0	0	0	113.5	G149 R153 D231	G149-N233 VanDerWaalsContact O-CB 3.24Å; G149-N233 WeakPolarHBondContact O-CB 3.22Å; R153-N233 HydrophobicContact CB-CB 4.47Å; R153-N233 WeakPolarHBondContact CD-OD1 3.29Å; R153-N233 PolarHBondContact NH1-OD1 3.12Å; D231-N233 PolarHBondContact O-N 2.98Å; D231-N233 VanDerWaalsContact O-N 3.13Å; D231-N233 PolarHBondContact OD1-ND2 3.15Å; D231-N233 WeakPolarHBondContact OD2-CA 3.41Å; D231-N233 VanDerWaalsContact OD2-CB 3.3Å; D231-N233 WeakPolarHBondContact OD2-CB 3.3Å; D231-N233 PolarHBondContact OD2-N 3.13Å; D231-N233 PolarHBondContact OD2-ND2 3.48Å
234	H	89.8	Confident	78.1	Confident	3 Å²	3	34.1 Å²	34.1	1%	0.014	19%	0.185	C	C	.	.			trans	-89.4	140.2	176.8	-75.5	66.6	0	0	0	111.9	A73 T137 A166 D231 P232 F237	A73-H234 WeakPolarHBondContact CB-O 3.41Å; T137-H234 PolarHBondContact OG1-NE2 2.52Å; A166-H234 HydrophobicContact CB-CB 4.49Å; D231-H234 PolarHBondContact O-N 3.33Å; D231-H234 IonicContact OD2-CE1 2.76Å; D231-H234 IonicContact OD2-ND1 2.76Å; D231-H234 PolarHBondContact OD2-ND1 3.4Å; P232-H234 VanDerWaalsContact C-N 3.35Å; H234-F237 HydrophobicContact CB-CE1 3.99Å; H234-F237 HydrophobicContact CB-CE2 4.17Å; H234-F237 HydrophobicContact CB-CZ 3.63Å
235	N	87.8	Confident	78.4	Confident	36 Å²	36	32.3 Å²	32.3	19%	0.193	18%	0.179	C	C	.	.	S	Bend	trans	-83	-32	-177	-55.7	107.6	0	0	0	113	A73 R74 M165 A166	A73-N235 WeakPolarHBondContact CA-O 3.32Å; R74-N235 PolarHBondContact N-O 2.88Å; M165-N235 WeakPolarHBondContact CA-OD1 3.3Å; A166-N235 PolarHBondContact N-OD1 3.17Å; A166-N235 PolarHBondContact O-N 3.02Å
236	F	91.5	Very high	78.1	Confident	19 Å²	19	33 Å²	33	8%	0.083	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	142.4	-173.2	-59	-80.1	0	0	0	111.7	R74 W95 L97 M165 A166 F167 G168	R74-F236 HydrophobicContact CB-CD1 3.95Å; R74-F236 HydrophobicContact CB-CE1 4.22Å; R74-F236 CarbonylContact O-C 3.56Å; R74-F236 VanDerWaalsContact O-CA 3.29Å; R74-F236 WeakPolarHBondContact O-CA 3.03Å; W95-F236 HydrophobicContact CB-CE1 4.23Å; W95-F236 AromaticContact CD2-CD1 3.67Å; W95-F236 HydrophobicContact CD2-CD1 3.67Å; W95-F236 HydrophobicContact CD2-CE1 4.06Å; W95-F236 HydrophobicContact CE3-CB 4.35Å; W95-F236 AromaticContact CE3-CD1 3.54Å; W95-F236 HydrophobicContact CE3-CD1 3.54Å; W95-F236 HydrophobicContact CE3-CE1 4.15Å; W95-F236 HydrophobicContact CE3-CG 4.05Å; W95-F236 HydrophobicContact CG-CD1 4.21Å; W95-F236 HydrophobicContact CG-CE1 4.12Å; W95-F236 HydrophobicContact CH2-CB 4.02Å; W95-F236 HydrophobicContact CH2-CD1 4.27Å; W95-F236 HydrophobicContact CZ2-CD1 4.36Å; W95-F236 HydrophobicContact CZ3-CB 3.83Å; W95-F236 AromaticContact CZ3-CD1 3.89Å; W95-F236 HydrophobicContact CZ3-CD1 3.89Å; W95-F236 HydrophobicContact CZ3-CG 4.05Å; L97-F236 HydrophobicContact CD1-CE2 4.46Å; L97-F236 HydrophobicContact CD1-CZ 4.36Å; L97-F236 HydrophobicContact CD2-CE1 4.3Å; L97-F236 HydrophobicContact CD2-CE2 3.9Å; L97-F236 HydrophobicContact CD2-CZ 3.56Å; L97-F236 HydrophobicContact CG-CZ 4.43Å; M165-F236 HydrophobicContact SD-CE2 4.01Å; A166-F236 PolarHBondContact O-N 3.29Å; F167-F236 CarbonylContact C-O 3.56Å; F167-F236 WeakPolarHBondContact CA-O 3.47Å; F167-F236 HydrophobicContact CD1-CB 3.45Å; F167-F236 VanDerWaalsContact CD1-CB 3.45Å; F167-F236 HydrophobicContact CD1-CD2 4.09Å; F167-F236 AromaticContact CD1-CG 3.99Å; F167-F236 HydrophobicContact CD1-CG 3.99Å; F167-F236 HydrophobicContact CE1-CB 3.62Å; F167-F236 HydrophobicContact CE1-CD1 4.45Å; F167-F236 AromaticContact CE1-CD2 3.59Å; F167-F236 HydrophobicContact CE1-CD2 3.59Å; F167-F236 HydrophobicContact CE1-CE2 4.46Å; F167-F236 AromaticContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE2-CD2 4.11Å; F167-F236 HydrophobicContact CG-CB 4.17Å; F167-F236 HydrophobicContact CZ-CB 4.45Å; F167-F236 AromaticContact CZ-CD2 3.59Å; F167-F236 HydrophobicContact CZ-CD2 3.59Å; F167-F236 HydrophobicContact CZ-CE2 4.15Å; F167-F236 HydrophobicContact CZ-CG 4.11Å; G168-F236 PolarHBondContact N-O 3.31Å
237	F	91.9	Very high	77.8	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	133.5	176.1	-67.1	-80.2	0	0	0	112.5	I64 F66 A73 R74 F75 C76 G139 G168 L230 D231 H234 L239	I64-F237 HydrophobicContact CD1-CD2 3.98Å; I64-F237 HydrophobicContact CD1-CE2 4.39Å; F66-F237 AromaticContact CE2-CE2 3.94Å; F66-F237 HydrophobicContact CE2-CE2 3.94Å; F66-F237 HydrophobicContact CE2-CZ 4.46Å; F66-F237 AromaticContact CZ-CE2 3.76Å; F66-F237 HydrophobicContact CZ-CE2 3.76Å; F66-F237 AromaticContact CZ-CZ 3.95Å; F66-F237 HydrophobicContact CZ-CZ 3.95Å; A73-F237 HydrophobicContact CB-CD2 3.87Å; A73-F237 HydrophobicContact CB-CE2 3.65Å; R74-F237 PolarHBondContact O-N 3.35Å; F75-F237 CarbonylContact C-O 3.56Å; F75-F237 VanDerWaalsContact CA-O 3.25Å; F75-F237 WeakPolarHBondContact CA-O 3.32Å; F75-F237 HydrophobicContact CB-CB 3.74Å; C76-F237 PolarHBondContact N-O 3.02Å; G139-F237 WeakPolarHBondContact O-CE1 3.31Å; G168-F237 CarbonylContact O-C 3.58Å; G168-F237 WeakPolarHBondContact O-CA 3.31Å; L230-F237 HydrophobicContact CB-CE1 4.14Å; L230-F237 HydrophobicContact CB-CZ 4.12Å; L230-F237 HydrophobicContact CD1-CD1 4.49Å; L230-F237 HydrophobicContact CD2-CD1 3.96Å; L230-F237 HydrophobicContact CD2-CE1 3.88Å; L230-F237 HydrophobicContact CG-CE1 4.41Å; D231-F237 WeakPolarHBondContact O-CZ 3.37Å; H234-F237 HydrophobicContact CB-CE1 3.99Å; H234-F237 HydrophobicContact CB-CE2 4.17Å; H234-F237 HydrophobicContact CB-CZ 3.63Å; F237-L239 HydrophobicContact CB-CD2 4.24Å; F237-L239 HydrophobicContact CB-CG 4.47Å
238	V	90.4	Very high	77	Confident	1 Å²	1	30 Å²	30	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	104.3	171.6	-177.8	0	0	0	0	107.2	L78 W95 G168 V169 A170 L255 F259	L78-V238 HydrophobicContact CD1-CG1 3.7Å; L78-V238 HydrophobicContact CG-CG1 4.38Å; W95-V238 HydrophobicContact CH2-CG2 4.07Å; G168-V238 PolarHBondContact O-N 2.84Å; V169-V238 WeakPolarHBondContact CA-O 3.4Å; V169-V238 HydrophobicContact CG2-CB 4.29Å; A170-V238 PolarHBondContact N-O 3.06Å; V238-L255 HydrophobicContact CG1-CD2 3.9Å; V238-F259 HydrophobicContact CG2-CD2 4.48Å; V238-F259 HydrophobicContact CG2-CE2 3.98Å; V238-F259 HydrophobicContact CG2-CZ 4.05Å
239	L	89.2	Confident	76.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.1	-175.5	-52.7	178.5	0	0	0	109.6	F75 C76 K77 L78 A170 W172 V175 L181 L230 F237	F75-L239 HydrophobicContact CD2-CD1 3.73Å; F75-L239 HydrophobicContact CE2-CD1 4.4Å; F75-L239 HydrophobicContact CG-CD1 4.48Å; C76-L239 PolarHBondContact O-N 2.86Å; K77-L239 WeakPolarHBondContact CA-O 3.33Å; L78-L239 PolarHBondContact N-O 3.04Å; A170-L239 HydrophobicContact CB-CD2 3.95Å; A170-L239 CarbonylContact O-C 3.59Å; A170-L239 WeakPolarHBondContact O-CA 3.32Å; W172-L239 HydrophobicContact CE3-CB 3.86Å; W172-L239 HydrophobicContact CE3-CD1 3.6Å; W172-L239 HydrophobicContact CE3-CG 4.36Å; W172-L239 HydrophobicContact CZ3-CD1 3.59Å; V175-L239 HydrophobicContact CG2-CD2 4.23Å; L181-L239 HydrophobicContact CD1-CD1 3.94Å; L230-L239 HydrophobicContact CD2-CD2 4.33Å; F237-L239 HydrophobicContact CB-CD2 4.24Å; F237-L239 HydrophobicContact CB-CG 4.47Å
240	V	86.3	Confident	75.2	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.8	-173.6	-173.5	0	0	0	0	110.7	L78 V169 A170 W172 E252 L255	L78-V240 CarbonylContact O-C 3.59Å; L78-V240 WeakPolarHBondContact O-CA 3.39Å; V169-V240 HydrophobicContact CG1-CG2 4.29Å; A170-V240 PolarHBondContact O-N 3.02Å; W172-V240 VanDerWaalsContact CB-O 3.27Å; W172-V240 WeakPolarHBondContact CB-O 3.31Å; W172-V240 PolarHBondContact N-O 2.91Å; V240-E252 HydrophobicContact CG2-CB 4.35Å; V240-L255 HydrophobicContact CG1-CB 4.34Å; V240-L255 HydrophobicContact CG1-CD1 4.1Å; V240-L255 HydrophobicContact CG2-CB 4.11Å; V240-L255 HydrophobicContact CG2-CD1 4.03Å; V240-L255 HydrophobicContact CG2-CD2 3.63Å; V240-L255 HydrophobicContact CG2-CG 4.11Å
241	D	80	Confident	74.2	Confident	42 Å²	42	33.2 Å²	33.2	23%	0.225	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116.7	178.3	-175.8	0.7	0	0	0	110.7	K77 L78 N79 W172 G243	K77-D241 WeakPolarHBondContact CE-OD2 3.36Å; K77-D241 HydrophobicContact CG-CB 4.46Å; K77-D241 IonicContact NZ-OD2 2.69Å; K77-D241 PolarHBondContact NZ-OD2 3.22Å; L78-D241 PolarHBondContact O-N 3Å; N79-D241 WeakPolarHBondContact CA-O 3.46Å; N79-D241 PolarHBondContact OD1-O 2.93Å; W172-D241 HydrophobicContact CB-CB 4.18Å; W172-D241 HydrophobicContact CG-CB 4.42Å; D241-G243 PolarHBondContact OD1-N 3.32Å; D241-G243 VanDerWaalsContact OD1-N 3.08Å
242	D	66.2	Low	73.8	Confident	36 Å²	36	34.1 Å²	34.1	19%	0.193	19%	0.189	C	C	.	.			trans	-105.7	-12.8	179.2	-71	-8.4	0	0	0	112.9	S80 T244 K251	S80-D242 WeakPolarHBondContact CB-OD1 3.36Å; D242-T244 PolarHBondContact O-N 3.27Å; D242-K251 WeakPolarHBondContact OD2-CB 3.48Å; D242-K251 WeakPolarHBondContact OD2-CD 3.39Å
243	G	61.1	Low	73.7	Confident	52 Å²	52	34 Å²	34	54%	0.536	19%	0.189	S	C	.	.			trans	62.9	-8.7	-178.3	0	0	0	0	0	117.5	D241 T245	D241-G243 PolarHBondContact OD1-N 3.32Å; D241-G243 VanDerWaalsContact OD1-N 3.08Å; G243-T245 PolarHBondContact O-N 3.2Å
244	T	58.6	Low	73.5	Confident	22 Å²	22	37.7 Å²	37.7	14%	0.135	21%	0.205	C	C	.	.			trans	-83.5	78.7	-176.8	58.7	0	0	0	0	111.8	R9 D242 D246 Q247 L248 K251	R9-T244 HydrophobicContact CB-CG2 4.46Å; D242-T244 PolarHBondContact O-N 3.27Å; T244-D246 PolarHBondContact O-N 2.92Å; T244-Q247 PolarHBondContact O-N 3.44Å; T244-Q247 PolarHBondContact OG1-O 3.4Å; T244-L248 WeakPolarHBondContact O-CD2 3.24Å; T244-L248 VanDerWaalsContact O-CG 3.32Å; T244-L248 WeakPolarHBondContact O-CG 3.45Å; T244-K251 PolarHBondContact OG1-NZ 2.94Å
245	T	52.9	Low	73.3	Confident	107 Å²	107	37.5 Å²	37.5	66%	0.656	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-22.5	-180	21.5	0	0	0	0	114.2	G243	G243-T245 PolarHBondContact O-N 3.2Å
246	D	49.4	Very low	73.4	Confident	83 Å²	83	36 Å²	36	44%	0.444	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.6	174.9	-47.4	75.3	0	0	0	115.8	S11 T244	S11-D246 VanDerWaalsContact CB-CG 3.47Å; S11-D246 WeakPolarHBondContact CB-OD1 3.14Å; S11-D246 WeakPolarHBondContact CB-OD2 3.08Å; S11-D246 PolarHBondContact OG-OD1 2.7Å; S11-D246 PolarHBondContact OG-OD2 2.66Å; T244-D246 PolarHBondContact O-N 2.92Å
247	Q	54.3	Low	73.2	Confident	133 Å²	133	35.1 Å²	35.1	62%	0.621	19%	0.192	S	C	*	.	S	Bend	trans	-157.8	102.4	-167.8	-71.1	-176.1	-15.6	0	0	113.4	T244 K251	T244-Q247 PolarHBondContact O-N 3.44Å; T244-Q247 PolarHBondContact OG1-O 3.4Å; Q247-K251 WeakPolarHBondContact O-CE 3.47Å; Q247-K251 PolarHBondContact O-NZ 3.42Å
248	L	53	Low	73	Confident	23 Å²	23	37.3 Å²	37.3	12%	0.12	20%	0.201	C	C	.	.			trans	-133.4	-22.8	-157.6	-74	169.5	0	0	0	121.5	D173 I225 T244	D173-L248 HydrophobicContact CB-CD1 3.96Å; D173-L248 HydrophobicContact CB-CD2 4.05Å; D173-L248 WeakPolarHBondContact OD2-CD2 3.17Å; I225-L248 HydrophobicContact CD1-CD1 4.13Å; T244-L248 WeakPolarHBondContact O-CD2 3.24Å; T244-L248 VanDerWaalsContact O-CG 3.32Å; T244-L248 WeakPolarHBondContact O-CG 3.45Å
249	K	60.8	Low	72.9	Confident	71 Å²	71	37.4 Å²	37.4	31%	0.309	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	130.5	178.7	-75.1	-176	175.1	-179.7	0	111.9	E226 F417	E226-K249 IonicContact OE2-NZ 2.72Å; E226-K249 PolarHBondContact OE2-NZ 3.06Å; K249-F417 HydrophobicContact CB-CD1 4.47Å; K249-F417 HydrophobicContact CB-CE1 4Å; K249-F417 HydrophobicContact CB-CE2 4.12Å; K249-F417 HydrophobicContact CB-CZ 3.81Å; K249-F417 HydrophobicContact CD-CE2 4.48Å; K249-F417 VanDerWaalsContact O-CE1 3.3Å; K249-F417 WeakPolarHBondContact O-CE1 3.46Å
250	G	65.3	Low	72.9	Confident	3 Å²	3	37.4 Å²	37.4	3%	0.031	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.5	5.3	171.9	0	0	0	0	0	116.7	E252 A253	G250-E252 WeakPolarHBondContact CA-OE2 3.4Å; G250-E252 PolarHBondContact N-OE2 2.75Å; G250-A253 WeakPolarHBondContact O-CB 3.22Å
251	K	68.4	Low	72.8	Confident	54 Å²	54	43.5 Å²	43.5	24%	0.235	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-16.7	175.8	-71.3	-175.4	174.6	162.9	0	113.3	D242 T244 Q247 A253	D242-K251 WeakPolarHBondContact OD2-CB 3.48Å; D242-K251 WeakPolarHBondContact OD2-CD 3.39Å; T244-K251 PolarHBondContact OG1-NZ 2.94Å; Q247-K251 WeakPolarHBondContact O-CE 3.47Å; Q247-K251 PolarHBondContact O-NZ 3.42Å; K251-A253 PolarHBondContact O-N 3.38Å
252	E	80.2	Confident	73	Confident	19 Å²	19	41.6 Å²	41.6	9%	0.089	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-19	173	72.5	-71.3	159.6	0	0	113.1	V240 G250 E254 L255 R256 Q421	V240-E252 HydrophobicContact CG2-CB 4.35Å; G250-E252 WeakPolarHBondContact CA-OE2 3.4Å; G250-E252 PolarHBondContact N-OE2 2.75Å; E252-E254 VanDerWaalsContact C-N 3.28Å; E252-E254 PolarHBondContact O-N 2.78Å; E252-L255 PolarHBondContact O-N 3.06Å; E252-R256 VanDerWaalsContact O-CB 3.25Å; E252-R256 WeakPolarHBondContact O-CB 3.33Å; E252-R256 PolarHBondContact O-N 3.17Å; E252-Q421 PolarHBondContact OE1-NE2 2.84Å
253	A	82.9	Confident	73.9	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.033	21%	0.205	C	C	.	.	H	α-helix	trans	-53.9	-40.2	179.5	0	0	0	0	0	113.3	G250 K251 A257 Q421 C424	G250-A253 WeakPolarHBondContact O-CB 3.22Å; K251-A253 PolarHBondContact O-N 3.38Å; A253-A257 WeakPolarHBondContact O-CB 3.39Å; A253-A257 PolarHBondContact O-N 3.32Å; A253-Q421 HydrophobicContact CB-CB 4.48Å; A253-Q421 HydrophobicContact CB-CG 3.82Å; A253-C424 HydrophobicContact CB-CB 4.4Å
254	E	82.6	Confident	74.9	Confident	82 Å²	82	38.4 Å²	38.4	38%	0.383	19%	0.186	S	C	.	.	H	α-helix	trans	-70.7	-46	-179	150.7	139	-126.3	0	0	112.1	E252 R258 R428	E252-E254 VanDerWaalsContact C-N 3.28Å; E252-E254 PolarHBondContact O-N 2.78Å; E254-R258 WeakPolarHBondContact O-CG 3.15Å; E254-R258 PolarHBondContact O-N 2.92Å; E254-R258 VanDerWaalsContact O-N 3.16Å; E254-R428 PolarHBondContact O-NH1 2.88Å; E254-R428 IonicContact OE1-CZ 3.78Å; E254-R428 IonicContact OE1-NH1 3.35Å; E254-R428 PolarHBondContact OE1-NH1 2.95Å; E254-R428 IonicContact OE1-NH2 3.77Å; E254-R428 PolarHBondContact OE1-NH2 2.8Å; E254-R428 IonicContact OE2-NH2 3.52Å; E254-R428 PolarHBondContact OE2-NH2 3Å
255	L	86.5	Confident	75.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-70.1	-38.2	177.9	-173.3	144.2	0	0	0	111	L78 N79 V169 V238 V240 E252 R258 F259	L78-L255 HydrophobicContact CB-CD1 4.31Å; N79-L255 WeakPolarHBondContact O-CD1 3.47Å; V169-L255 HydrophobicContact CG1-CD2 4.37Å; V238-L255 HydrophobicContact CG1-CD2 3.9Å; V240-L255 HydrophobicContact CG1-CB 4.34Å; V240-L255 HydrophobicContact CG1-CD1 4.1Å; V240-L255 HydrophobicContact CG2-CB 4.11Å; V240-L255 HydrophobicContact CG2-CD1 4.03Å; V240-L255 HydrophobicContact CG2-CD2 3.63Å; V240-L255 HydrophobicContact CG2-CG 4.11Å; E252-L255 PolarHBondContact O-N 3.06Å; L255-R258 CarbonylContact O-C 3.58Å; L255-R258 PolarHBondContact O-N 3.06Å; L255-R258 VanDerWaalsContact O-N 3.16Å; L255-F259 WeakPolarHBondContact O-CB 3.33Å; L255-F259 PolarHBondContact O-N 2.83Å
256	R	90	Very high	76.8	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.015	17%	0.174	C	C	.	.	H	α-helix	trans	-57.4	-48.8	173.6	-177.7	174.4	174.5	166.9	2.2	111.3	T105 V106 V136 V169 E252 R258 F259 E260	T105-R256 PolarHBondContact OG1-NE 2.97Å; T105-R256 PolarHBondContact OG1-NH2 3.16Å; V106-R256 PolarHBondContact O-NH2 3.28Å; V136-R256 HydrophobicContact CG1-CG 4.42Å; V136-R256 PolarHBondContact O-NH2 2.96Å; V169-R256 HydrophobicContact CB-CB 4.47Å; V169-R256 HydrophobicContact CB-CG 4.41Å; V169-R256 HydrophobicContact CG1-CB 3.99Å; V169-R256 HydrophobicContact CG1-CG 4.46Å; V169-R256 HydrophobicContact CG2-CG 4.43Å; E252-R256 VanDerWaalsContact O-CB 3.25Å; E252-R256 WeakPolarHBondContact O-CB 3.33Å; E252-R256 PolarHBondContact O-N 3.17Å; R256-R258 VanDerWaalsContact C-N 3.3Å; R256-R258 PolarHBondContact O-N 3.16Å; R256-F259 WeakPolarHBondContact O-CB 3.39Å; R256-F259 PolarHBondContact O-N 2.73Å; R256-E260 HydrophobicContact CG-CG 4.45Å; R256-E260 WeakPolarHBondContact CG-OE1 3.35Å; R256-E260 IonicContact NE-OE1 3.84Å; R256-E260 PolarHBondContact NE-OE1 2.77Å; R256-E260 WeakPolarHBondContact O-CB 3.32Å; R256-E260 VanDerWaalsContact O-CG 3.29Å; R256-E260 WeakPolarHBondContact O-CG 3.35Å; R256-E260 PolarHBondContact O-N 2.85Å
257	A	87.7	Confident	77.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-38.5	176.1	0	0	0	0	0	112.2	A253 R261 C424 R428 N429	A253-A257 WeakPolarHBondContact O-CB 3.39Å; A253-A257 PolarHBondContact O-N 3.32Å; A257-R261 WeakPolarHBondContact O-CB 3.46Å; A257-R261 PolarHBondContact O-N 2.77Å; A257-C424 HydrophobicContact CB-CB 4.47Å; A257-R428 HydrophobicContact CB-CB 4.36Å; A257-N429 PolarHBondContact O-ND2 3.28Å; A257-N429 PolarHBondContact O-OD1 2.73Å
258	R	87.2	Confident	76.8	Confident	47 Å²	47	35.3 Å²	35.3	18%	0.177	17%	0.173	C	C	.	.	H	α-helix	trans	-70.8	-35.8	176	-69.4	172.6	61.1	-147.5	-7.6	113	S80 T82 D84 E254 L255 R256 R261 C262	S80-R258 PolarHBondContact O-NH1 3.31Å; T82-R258 PolarHBondContact O-NH1 3.28Å; T82-R258 PolarHBondContact O-NH2 2.61Å; D84-R258 IonicContact OD1-CZ 2.73Å; D84-R258 IonicContact OD1-NE 2.85Å; D84-R258 PolarHBondContact OD1-NE 3.06Å; D84-R258 IonicContact OD1-NH2 3.98Å; D84-R258 PolarHBondContact OD1-NH2 3.38Å; E254-R258 WeakPolarHBondContact O-CG 3.15Å; E254-R258 PolarHBondContact O-N 2.92Å; E254-R258 VanDerWaalsContact O-N 3.16Å; L255-R258 CarbonylContact O-C 3.58Å; L255-R258 PolarHBondContact O-N 3.06Å; L255-R258 VanDerWaalsContact O-N 3.16Å; R256-R258 VanDerWaalsContact C-N 3.3Å; R256-R258 PolarHBondContact O-N 3.16Å; R258-R261 PolarHBondContact O-N 3.35Å; R258-C262 PolarHBondContact O-N 2.69Å; R258-C262 PolarHBondContact O-SG 2.84Å
259	F	88.7	Confident	75.8	Confident	3 Å²	3	37.9 Å²	37.9	1%	0.013	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-50.1	174.8	176.8	-107.1	0	0	0	110.9	L87 L91 V136 F167 V169 V238 L255 R256 R261 C262 I263	L87-F259 HydrophobicContact CD2-CD2 4.25Å; L91-F259 HydrophobicContact CD1-CE2 4.02Å; L91-F259 HydrophobicContact CD2-CE2 3.98Å; L91-F259 HydrophobicContact CD2-CZ 4.21Å; L91-F259 HydrophobicContact CG-CE2 4.33Å; V136-F259 HydrophobicContact CG1-CD1 4.46Å; V136-F259 HydrophobicContact CG1-CE1 4.48Å; V136-F259 HydrophobicContact CG2-CE1 4.34Å; F167-F259 HydrophobicContact CB-CE1 4.34Å; F167-F259 HydrophobicContact CD1-CE1 4.31Å; F167-F259 AromaticContact CD1-CZ 3.79Å; F167-F259 HydrophobicContact CD1-CZ 3.79Å; F167-F259 HydrophobicContact CE1-CZ 4.3Å; F167-F259 HydrophobicContact CG-CE1 4.42Å; F167-F259 HydrophobicContact CG-CZ 4.33Å; V169-F259 HydrophobicContact CG2-CD1 4.05Å; V169-F259 HydrophobicContact CG2-CE1 4.29Å; V238-F259 HydrophobicContact CG2-CD2 4.48Å; V238-F259 HydrophobicContact CG2-CE2 3.98Å; V238-F259 HydrophobicContact CG2-CZ 4.05Å; L255-F259 WeakPolarHBondContact O-CB 3.33Å; L255-F259 PolarHBondContact O-N 2.83Å; R256-F259 WeakPolarHBondContact O-CB 3.39Å; R256-F259 PolarHBondContact O-N 2.73Å; F259-R261 VanDerWaalsContact C-N 3.3Å; F259-R261 PolarHBondContact O-N 3.1Å; F259-C262 WeakPolarHBondContact O-CB 3.25Å; F259-C262 PolarHBondContact O-N 2.84Å; F259-I263 HydrophobicContact CD1-CD1 3.88Å; F259-I263 HydrophobicContact CE1-CD1 3.42Å; F259-I263 VanDerWaalsContact CE1-CD1 3.42Å; F259-I263 HydrophobicContact CE2-CD1 4.21Å; F259-I263 HydrophobicContact CG-CD1 4.45Å; F259-I263 HydrophobicContact CZ-CD1 3.61Å; F259-I263 HydrophobicContact CZ-CG1 4.45Å; F259-I263 WeakPolarHBondContact O-CG1 3.29Å; F259-I263 PolarHBondContact O-N 3.31Å; F259-I263 VanDerWaalsContact O-N 3.09Å
260	E	88.7	Confident	74.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-52	-47.6	172.2	-76.7	172.7	-175	0	0	111.3	T105 R256 C262 I263 S264 M407 S425 N429	T105-E260 WeakPolarHBondContact CB-OE1 3.27Å; T105-E260 PolarHBondContact OG1-OE1 2.94Å; R256-E260 HydrophobicContact CG-CG 4.45Å; R256-E260 WeakPolarHBondContact CG-OE1 3.35Å; R256-E260 IonicContact NE-OE1 3.84Å; R256-E260 PolarHBondContact NE-OE1 2.77Å; R256-E260 WeakPolarHBondContact O-CB 3.32Å; R256-E260 VanDerWaalsContact O-CG 3.29Å; R256-E260 WeakPolarHBondContact O-CG 3.35Å; R256-E260 PolarHBondContact O-N 2.85Å; E260-C262 PolarHBondContact O-N 2.81Å; E260-I263 PolarHBondContact O-N 2.82Å; E260-S264 PolarHBondContact O-N 3.17Å; E260-M407 VanDerWaalsContact C-CE 3.44Å; E260-M407 HydrophobicContact CB-CE 3.6Å; E260-M407 HydrophobicContact CB-SD 3.89Å; E260-M407 HydrophobicContact CG-CE 4.47Å; E260-M407 HydrophobicContact CG-SD 4.32Å; E260-M407 WeakPolarHBondContact O-CE 3.3Å; E260-S425 PolarHBondContact OE2-OG 3.21Å; E260-N429 PolarHBondContact OE2-ND2 3.26Å
261	R	84.5	Confident	72.2	Confident	128 Å²	128	44.9 Å²	44.9	48%	0.483	26%	0.255	S	S	.	.	H	α-helix	trans	-60.9	-40.9	175.9	-168.6	176.5	174.5	172.3	0.9	113.2	A257 R258 F259 I263 S264 L265 N429	A257-R261 WeakPolarHBondContact O-CB 3.46Å; A257-R261 PolarHBondContact O-N 2.77Å; R258-R261 PolarHBondContact O-N 3.35Å; F259-R261 VanDerWaalsContact C-N 3.3Å; F259-R261 PolarHBondContact O-N 3.1Å; R261-I263 VanDerWaalsContact C-N 3.29Å; R261-I263 PolarHBondContact O-N 3.25Å; R261-S264 PolarHBondContact O-N 2.77Å; R261-L265 HydrophobicContact CG-CD1 3.97Å; R261-L265 WeakPolarHBondContact O-CG 3.48Å; R261-L265 PolarHBondContact O-N 2.8Å; R261-L265 VanDerWaalsContact O-N 3.11Å; R261-N429 WeakPolarHBondContact CB-OD1 3.44Å
262	C	84.2	Confident	70.1	Confident	3 Å²	3	48 Å²	48	2%	0.02	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-37.1	178.5	-74.6	0	0	0	0	112	R258 F259 E260	R258-C262 PolarHBondContact O-N 2.69Å; R258-C262 PolarHBondContact O-SG 2.84Å; F259-C262 WeakPolarHBondContact O-CB 3.25Å; F259-C262 PolarHBondContact O-N 2.84Å; E260-C262 PolarHBondContact O-N 2.81Å
263	I	85.3	Confident	67.4	Low	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-72.8	-42.1	176.2	-57.2	167.5	0	0	0	110.4	L91 P100 I103 W134 F259 E260 R261 L265 W266	L91-I263 HydrophobicContact CD1-CG1 3.83Å; P100-I263 HydrophobicContact CG-CG2 3.57Å; I103-I263 HydrophobicContact CD1-CB 3.79Å; I103-I263 HydrophobicContact CD1-CG2 3.42Å; I103-I263 VanDerWaalsContact CD1-CG2 3.42Å; I103-I263 HydrophobicContact CG1-CG2 3.9Å; W134-I263 HydrophobicContact CE3-CD1 4.23Å; W134-I263 HydrophobicContact CE3-CG2 3.79Å; W134-I263 HydrophobicContact CZ3-CD1 4.39Å; W134-I263 HydrophobicContact CZ3-CG1 4.42Å; W134-I263 HydrophobicContact CZ3-CG2 3.9Å; F259-I263 HydrophobicContact CD1-CD1 3.88Å; F259-I263 HydrophobicContact CE1-CD1 3.42Å; F259-I263 VanDerWaalsContact CE1-CD1 3.42Å; F259-I263 HydrophobicContact CE2-CD1 4.21Å; F259-I263 HydrophobicContact CG-CD1 4.45Å; F259-I263 HydrophobicContact CZ-CD1 3.61Å; F259-I263 HydrophobicContact CZ-CG1 4.45Å; F259-I263 WeakPolarHBondContact O-CG1 3.29Å; F259-I263 PolarHBondContact O-N 3.31Å; F259-I263 VanDerWaalsContact O-N 3.09Å; E260-I263 PolarHBondContact O-N 2.82Å; R261-I263 VanDerWaalsContact C-N 3.29Å; R261-I263 PolarHBondContact O-N 3.25Å; I263-L265 VanDerWaalsContact C-N 3.27Å; I263-L265 PolarHBondContact O-N 3.04Å; I263-W266 WeakPolarHBondContact O-CB 3.28Å; I263-W266 PolarHBondContact O-N 2.81Å
264	S	81.7	Confident	64.6	Low	21 Å²	21	64.2 Å²	64.2	15%	0.147	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-35	178.9	-179.3	0	0	0	0	113.1	E260 R261 W266 V405	E260-S264 PolarHBondContact O-N 3.17Å; R261-S264 PolarHBondContact O-N 2.77Å; S264-W266 PolarHBondContact O-N 3.19Å; S264-V405 PolarHBondContact O-N 3.45Å; S264-V405 PolarHBondContact OG-O 3.32Å
265	L	79.2	Confident	61.8	Low	78 Å²	78	68.9 Å²	68.9	41%	0.408	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	5.7	176.6	-68.2	165.3	0	0	0	113.9	R261 I263 N267 L404	R261-L265 HydrophobicContact CG-CD1 3.97Å; R261-L265 WeakPolarHBondContact O-CG 3.48Å; R261-L265 PolarHBondContact O-N 2.8Å; R261-L265 VanDerWaalsContact O-N 3.11Å; I263-L265 VanDerWaalsContact C-N 3.27Å; I263-L265 PolarHBondContact O-N 3.04Å; L265-N267 PolarHBondContact O-N 3.17Å; L265-N267 VanDerWaalsContact O-N 3.08Å; L265-L404 HydrophobicContact CD2-CD2 3.41Å; L265-L404 VanDerWaalsContact CD2-CD2 3.41Å; L265-L404 HydrophobicContact CG-CD2 4.2Å
266	W	72.5	Confident	58.8	Low	34 Å²	34	74.3 Å²	74.3	13%	0.129	41%	0.411	C	S	.	.			trans	-79.9	91.7	-176.4	-161.7	-19.3	0	0	0	111.4	L91 K92 L97 P99 W134 I263 S264 C268	L91-W266 HydrophobicContact CB-CH2 3.92Å; L91-W266 HydrophobicContact CB-CZ3 3.73Å; L91-W266 HydrophobicContact CD1-CZ3 4.3Å; K92-W266 HydrophobicContact CB-CH2 4.46Å; K92-W266 HydrophobicContact CB-CZ2 3.98Å; K92-W266 HydrophobicContact CG-CZ2 4.2Å; L97-W266 HydrophobicContact CB-CH2 3.97Å; L97-W266 VanDerWaalsContact O-CH2 3.3Å; L97-W266 WeakPolarHBondContact O-CH2 3.35Å; L97-W266 VanDerWaalsContact O-CZ2 3.25Å; L97-W266 WeakPolarHBondContact O-CZ2 3.46Å; P99-W266 HydrophobicContact CB-CD2 4.17Å; P99-W266 HydrophobicContact CB-CG 4.01Å; W134-W266 HydrophobicContact CH2-CE3 4.16Å; W134-W266 HydrophobicContact CH2-CH2 4.1Å; W134-W266 AromaticContact CH2-CZ3 3.44Å; W134-W266 HydrophobicContact CH2-CZ3 3.44Å; W134-W266 VanDerWaalsContact CH2-CZ3 3.44Å; W134-W266 HydrophobicContact CZ3-CE3 4.28Å; W134-W266 AromaticContact CZ3-CZ3 3.81Å; W134-W266 HydrophobicContact CZ3-CZ3 3.81Å; I263-W266 WeakPolarHBondContact O-CB 3.28Å; I263-W266 PolarHBondContact O-N 2.81Å; S264-W266 PolarHBondContact O-N 3.19Å; W266-C268 PolarHBondContact O-N 3.07Å
267	N	60.7	Low	55.7	Low	65 Å²	65	80.5 Å²	80.5	35%	0.348	45%	0.449	S	S	.	.			trans	-60.2	132	179.9	-90.5	-13.2	0	0	0	114.1	L265 A269 I403	L265-N267 PolarHBondContact O-N 3.17Å; L265-N267 VanDerWaalsContact O-N 3.08Å; N267-A269 HydrophobicContact CB-CB 4.47Å; N267-A269 PolarHBondContact O-N 2.87Å; N267-I403 PolarHBondContact OD1-O 3.06Å
268	C	43.3	Very low	52.7	Low	102 Å²	102	84.9 Å²	84.9	69%	0.689	48%	0.476	S	S	*	.			trans	-75.6	50.6	157.3	-94.1	0	0	0	0	111.2	P99 W266 S270	P99-C268 VanDerWaalsContact CG-SG 3.6Å; W266-C268 PolarHBondContact O-N 3.07Å; C268-S270 PolarHBondContact O-N 2.79Å
269	A	31.4	Very low	49.8	Very low	78 Å²	78	88.9 Å²	88.9	65%	0.645	51%	0.506	S	S	*	.			trans	-72.9	104	166.5	0	0	0	0	0	107.5	N267 S271	N267-A269 HydrophobicContact CB-CB 4.47Å; N267-A269 PolarHBondContact O-N 2.87Å; A269-S271 PolarHBondContact O-N 2.98Å
270	S	27.7	Very low	46.8	Very low	117 Å²	117	92.3 Å²	92.3	82%	0.818	53%	0.527	S	S	*	.			trans	-57.7	90.6	162.2	37.5	0	0	0	0	107.9	C268 P272	C268-S270 PolarHBondContact O-N 2.79Å; S270-P272 WeakPolarHBondContact O-CD 3.41Å
271	S	23.6	Very low	43.8	Very low	104 Å²	104	97.1 Å²	97.1	73%	0.727	56%	0.561	S	S	*	*			trans	-56.2	121.4	171.5	51.7	0	0	0	0	108.4	A269	A269-S271 PolarHBondContact O-N 2.98Å
272	P	23.3	Very low	41	Very low	119 Å²	119	96.7 Å²	96.7	77%	0.773	56%	0.564	S	S	*	*			trans	-61.5	142.4	170.9	25.6	-30.4	0	0	0	109	S270 E274	S270-P272 WeakPolarHBondContact O-CD 3.41Å; P272-E274 PolarHBondContact O-N 3.47Å
273	Q	23.7	Very low	38.3	Very low	178 Å²	178	99.9 Å²	99.9	83%	0.832	58%	0.579	S	S	*	*			trans	-30.3	117	172.5	-68.1	174.5	-48.6	0	0	112.2	Q275	Q273-Q275 PolarHBondContact O-N 3.22Å
274	E	24.3	Very low	35.4	Very low	185 Å²	185	105.4 Å²	105.4	86%	0.864	62%	0.617	S	S	*	*			trans	-60.4	102.9	167.6	-82.3	-176.6	153.6	0	0	109.1	P272 T276	P272-E274 PolarHBondContact O-N 3.47Å; E274-T276 PolarHBondContact O-N 3.47Å
275	Q	23.7	Very low	32.7	Very low	180 Å²	180	106.5 Å²	106.5	84%	0.841	63%	0.632	S	S	*	*			trans	-77.1	98.1	158.4	-78.5	179.5	4	0	0	107.9	Q273 T277	Q273-Q275 PolarHBondContact O-N 3.22Å; Q275-T277 PolarHBondContact O-N 3.02Å
276	T	24.2	Very low	30.4	Very low	114 Å²	114	107 Å²	107	70%	0.699	64%	0.64	S	S	*	*			trans	-83.2	103	160.9	-13.5	0	0	0	0	108.7	E274 T278	E274-T276 PolarHBondContact O-N 3.47Å; T276-T278 HydrophobicContact CG2-CG2 3.85Å
277	T	24.3	Very low	28.1	Very low	134 Å²	134	112.5 Å²	112.5	82%	0.822	67%	0.67	S	S	*	*			trans	-66.8	138.9	148.8	36.3	0	0	0	0	108.5	Q275	Q275-T277 PolarHBondContact O-N 3.02Å
278	T	24.9	Very low	26.4	Very low	92 Å²	92	114 Å²	114	56%	0.564	69%	0.686	S	S	*	*			trans	-142.9	-179.4	-174.2	67.5	0	0	0	0	111.6	T276 T280	T276-T278 HydrophobicContact CG2-CG2 3.85Å; T278-T280 PolarHBondContact O-N 3.31Å; T278-T280 PolarHBondContact OG1-N 3.2Å; T278-T280 VanDerWaalsContact OG1-N 3.1Å
279	V	26.2	Very low	25.5	Very low	131 Å²	131	113.9 Å²	113.9	79%	0.794	69%	0.686	S	S	*	*			trans	-62.6	-17.5	168.9	-177.4	0	0	0	0	112	S281	V279-S281 PolarHBondContact O-N 2.92Å
280	T	24.9	Very low	25.3	Very low	75 Å²	75	114.8 Å²	114.8	46%	0.46	68%	0.684	S	S	.	*			trans	55.2	31.6	178.4	52.3	0	0	0	0	114.6	T278 P756	T278-T280 PolarHBondContact O-N 3.31Å; T278-T280 PolarHBondContact OG1-N 3.2Å; T278-T280 VanDerWaalsContact OG1-N 3.1Å; T280-P756 WeakPolarHBondContact O-CG 3.34Å; T280-P756 WeakPolarHBondContact OG1-CD 3.26Å; T280-P756 WeakPolarHBondContact OG1-CG 3.35Å
281	S	26.7	Very low	25.1	Very low	102 Å²	102	113.9 Å²	113.9	71%	0.713	67%	0.673	S	S	*	*			trans	-60.7	138.2	173.5	47.4	0	0	0	0	112.2	V279 Q283	V279-S281 PolarHBondContact O-N 2.92Å; S281-Q283 PolarHBondContact O-N 3.48Å
282	Q	25.1	Very low	25.3	Very low	118 Å²	118	116.6 Å²	116.6	55%	0.551	67%	0.674	S	S	*	*			trans	-78.4	105.5	-172.2	-73.1	-170.5	-109.3	0	0	113.8
283	Q	27.9	Very low	25.5	Very low	70 Å²	70	118 Å²	118	33%	0.327	68%	0.675	S	S	.	*				67.2	103.2	121.8	-68.1	139.3	10.3	0	0	117.4	S281 P757 P758 L759	S281-Q283 PolarHBondContact O-N 3.48Å; Q283-P757 PolarHBondContact NE2-O 2.68Å; Q283-P758 VanDerWaalsContact NE2-CA 3.29Å; Q283-L759 VanDerWaalsContact CD-C 3.45Å; Q283-L759 VanDerWaalsContact NE2-N 3.1Å; Q283-L759 PolarHBondContact NE2-O 3.21Å; Q283-L759 PolarHBondContact OE1-O 2.99Å
284	S	24.4	Very low	25.7	Very low	116 Å²	116	114.8 Å²	114.8	81%	0.811	66%	0.66	S	S	*	*			trans	-152.7	161	178	57.4	0	0	0	0	111.2
285	G	24.9	Very low	25.6	Very low	44 Å²	44	111.6 Å²	111.6	45%	0.454	65%	0.645	S	S	.	*			trans	179.9	-179.4	174.2	0	0	0	0	0	111.8
286	P	30.4	Very low	25.6	Very low	88 Å²	88	108.7 Å²	108.7	57%	0.571	64%	0.642	S	S	*	*			cis	-85.6	-103.9	-2.5	34.5	-32	0	0	0	111.7
287	I	25	Very low	25.6	Very low	150 Å²	150	109.7 Å²	109.7	77%	0.769	64%	0.638	S	S	*	*			trans	72.9	107.3	-173.1	-56.4	177.8	0	0	0	110.7
288	S	24.8	Very low	25.7	Very low	97 Å²	97	111 Å²	111	68%	0.678	64%	0.641	S	S	*	*			cis	70.5	178.2	19.9	-25.5	0	0	0	0	113
289	S	24.6	Very low	25.6	Very low	99 Å²	99	109.1 Å²	109.1	69%	0.692	64%	0.639	S	S	*	*			cis	-168.1	142.8	-4.9	28.4	0	0	0	0	106.1
290	T	26	Very low	25.6	Very low	98 Å²	98	107.8 Å²	107.8	60%	0.601	63%	0.626	S	S	*	*			cis	-157.6	126	-11.2	27	0	0	0	0	104.7
291	T	24.6	Very low	25.5	Very low	97 Å²	97	109.3 Å²	109.3	60%	0.595	64%	0.64	S	S	*	*				46.7	109.4	84.4	57.2	0	0	0	0	113.7	Q294	T291-Q294 PolarHBondContact O-OE1 3.43Å; T291-Q294 PolarHBondContact OG1-OE1 3.08Å
292	H	28.1	Very low	25.4	Very low	162 Å²	162	109.5 Å²	109.5	75%	0.75	64%	0.637	S	S	*	*	S	Bend	trans	-151.4	126	177.2	-113.6	-82.4	0	0	0	108.8
293	L	27	Very low	25.4	Very low	149 Å²	149	109.8 Å²	109.8	78%	0.78	65%	0.652	S	S	*	*			cis	-121	154.5	-6.2	-75.9	82.8	0	0	0	110.2
294	Q	27	Very low	25.2	Very low	110 Å²	110	111.6 Å²	111.6	51%	0.514	67%	0.672	S	S	.	*			cis	64.4	88	-18.8	-168	158.5	95.5	0	0	114.4	T291	T291-Q294 PolarHBondContact O-OE1 3.43Å; T291-Q294 PolarHBondContact OG1-OE1 3.08Å
295	Q	24.1	Very low	25.2	Very low	117 Å²	117	112.7 Å²	112.7	55%	0.547	67%	0.669	S	S	.	*				-173.5	163.1	77	-91.8	172.8	-0.4	0	0	111.3	Q297	Q295-Q297 HydrophobicContact CB-CG 4.09Å; Q295-Q297 HydrophobicContact CG-CG 3.94Å; Q295-Q297 VanDerWaalsContact OE1-CG 3.31Å
296	P	23.2	Very low	25.2	Very low	120 Å²	120	117.3 Å²	117.3	78%	0.779	69%	0.688	S	S	*	*			cis	-67.6	161.4	38.2	-28.5	38.4	0	0	0	117.5
297	Q	23.3	Very low	24.9	Very low	134 Å²	134	118.7 Å²	118.7	63%	0.626	69%	0.69	S	S	*	*			cis	69.8	159.9	22.9	-55.5	-166.8	33.6	0	0	115.9	Q295	Q295-Q297 HydrophobicContact CB-CG 4.09Å; Q295-Q297 HydrophobicContact CG-CG 3.94Å; Q295-Q297 VanDerWaalsContact OE1-CG 3.31Å
298	N	25.6	Very low	24.9	Very low	163 Å²	163	118.4 Å²	118.4	87%	0.872	69%	0.691	S	S	*	*			trans	-145.3	137.9	175	-55.4	107.7	0	0	0	108.9
299	G	24.2	Very low	25.1	Very low	51 Å²	51	120.6 Å²	120.6	53%	0.526	70%	0.695	S	S	.	*			trans	165.9	-175.5	-176	0	0	0	0	0	109.9
300	I	26.6	Very low	25.1	Very low	104 Å²	104	121.5 Å²	121.5	53%	0.533	70%	0.696	S	S	.	*			trans	-138.8	140.6	172.1	-31.5	83.9	0	0	0	108.3	E772	I300-E772 VanDerWaalsContact C-OE2 3.26Å; I300-E772 HydrophobicContact CB-CB 4.27Å; I300-E772 WeakPolarHBondContact CB-OE2 3.36Å; I300-E772 VanDerWaalsContact CG2-OE2 3.3Å; I300-E772 WeakPolarHBondContact CG2-OE2 3.41Å; I300-E772 PolarHBondContact O-N 3.38Å; I300-E772 VanDerWaalsContact O-N 3.12Å
301	S	21.5	Very low	25.3	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	71%	0.706	S	S	*	*			trans	-161.2	147.3	-175	57.4	0	0	0	0	110.7	E772	S301-E772 WeakPolarHBondContact CA-OE1 3.48Å; S301-E772 PolarHBondContact N-OE2 3.35Å
302	T	25.8	Very low	25.4	Very low	106 Å²	106	127.3 Å²	127.3	65%	0.65	72%	0.719	S	S	*	*			trans	-124.5	164.2	-161.3	40.6	0	0	0	0	115.7	E772	T302-E772 WeakPolarHBondContact CG2-OE1 3.28Å; T302-E772 PolarHBondContact N-OE1 2.84Å; T302-E772 PolarHBondContact OG1-OE1 2.86Å
303	S	23.5	Very low	25.4	Very low	124 Å²	124	123.2 Å²	123.2	87%	0.867	72%	0.72	S	S	*	*			trans	74.2	132	-178.1	79.6	0	0	0	0	115.1
304	S	23.4	Very low	25.4	Very low	107 Å²	107	119.3 Å²	119.3	75%	0.748	72%	0.716	S	S	*	*			cis	-163.4	131.9	20.5	50	0	0	0	0	110.8
305	N	24.9	Very low	25.4	Very low	140 Å²	140	121.6 Å²	121.6	75%	0.749	73%	0.731	S	S	*	*			trans	23.1	106.2	146.6	-68.6	-17.7	0	0	0	119.6
306	V	25.3	Very low	25.7	Very low	140 Å²	140	121.9 Å²	121.9	85%	0.848	73%	0.732	S	S	*	*				-150	84.7	126.4	179.4	0	0	0	0	104.8
307	N	23.5	Very low	25.9	Very low	117 Å²	117	121 Å²	121	63%	0.626	71%	0.713	S	S	*	*				38.7	99.3	93.7	-83	-3.3	0	0	0	114.4
308	N	26.6	Very low	26.2	Very low	145 Å²	145	120 Å²	120	78%	0.775	71%	0.709	S	S	*	*			trans	169.7	81.3	140.5	-83.1	-8.7	0	0	0	104.4	V310	N308-V310 VanDerWaalsContact C-N 3.31Å
309	N	27.2	Very low	26.3	Very low	143 Å²	143	115.2 Å²	115.2	77%	0.765	70%	0.698	S	S	*	*				29.1	68.9	60.7	-86.8	3.8	0	0	0	112.2
310	V	26.6	Very low	26.5	Very low	118 Å²	118	116.5 Å²	116.5	72%	0.715	70%	0.699	S	S	*	*			trans	-120	69.5	141.7	-174	0	0	0	0	105	N308 L312	N308-V310 VanDerWaalsContact C-N 3.31Å; V310-L312 HydrophobicContact CG1-CB 4.05Å
311	N	29.8	Very low	26.5	Very low	152 Å²	152	115.8 Å²	115.8	81%	0.813	70%	0.699	S	S	*	*				-53.9	112.3	109.9	-91.3	-18.4	0	0	0	112.7
312	L	25.7	Very low	26.9	Very low	165 Å²	165	115 Å²	115	86%	0.864	69%	0.685	S	S	*	*			trans	-161	126.6	156.4	-131.9	92.4	0	0	0	105.3	V310	V310-L312 HydrophobicContact CG1-CB 4.05Å
313	G	28.1	Very low	27	Very low	76 Å²	76	111.9 Å²	111.9	78%	0.784	67%	0.674	S	S	*	*			cis	-174.7	131.1	0.4	0	0	0	0	0	104.8
314	G	27.7	Very low	27.2	Very low	67 Å²	67	109.9 Å²	109.9	69%	0.691	67%	0.673	S	S	*	*				121.2	137.7	100.1	0	0	0	0	0	107.3
315	L	26	Very low	27.3	Very low	158 Å²	158	113.8 Å²	113.8	83%	0.827	68%	0.68	S	S	*	*			cis	-146.2	143.6	15.8	-77.2	98.2	0	0	0	107.6
316	Q	30.8	Very low	27.4	Very low	122 Å²	122	111.8 Å²	111.8	57%	0.57	68%	0.682	S	S	*	*			cis	75.8	149.4	42.7	-150.7	171	5.1	0	0	112.6
317	R	26.9	Very low	27.4	Very low	101 Å²	101	109.8 Å²	109.8	38%	0.381	68%	0.675	S	S	.	*			cis	-90.1	176	-1.9	-86.6	62.9	164.6	-114.5	-27.1	113.3	D816 D818	R317-D816 WeakPolarHBondContact CD-OD1 3.45Å; R317-D816 IonicContact CZ-OD1 2.75Å; R317-D816 IonicContact CZ-OD2 3.72Å; R317-D816 IonicContact NE-OD1 2.89Å; R317-D816 IonicContact NH1-OD1 3.19Å; R317-D816 PolarHBondContact NH1-OD1 2.94Å; R317-D816 IonicContact NH1-OD2 2.84Å; R317-D816 PolarHBondContact NH1-OD2 3.46Å; R317-D816 IonicContact NH2-OD2 2.82Å; R317-D818 IonicContact CZ-OD1 3.84Å; R317-D818 IonicContact CZ-OD2 3.26Å; R317-D818 IonicContact NE-OD1 3.45Å; R317-D818 PolarHBondContact NE-OD1 3.25Å; R317-D818 IonicContact NE-OD2 2.76Å; R317-D818 IonicContact NH2-OD1 2.94Å; R317-D818 PolarHBondContact NH2-OD1 3.31Å; R317-D818 VanDerWaalsContact NH2-OD1 3.17Å; R317-D818 IonicContact NH2-OD2 3.4Å; R317-D818 PolarHBondContact NH2-OD2 3.48Å
318	Q	31	Very low	27.5	Very low	114 Å²	114	109.7 Å²	109.7	53%	0.533	68%	0.678	S	S	.	*			cis	89.9	149.8	5.8	-70.9	-174.5	-26.9	0	0	120.3	Y817 D818	Q318-Y817 CarbonylContact O-C 3.54Å; Q318-D818 PolarHBondContact O-N 3.09Å; Q318-D818 VanDerWaalsContact O-N 3.13Å
319	G	28.2	Very low	27.5	Very low	62 Å²	62	108.7 Å²	108.7	64%	0.639	68%	0.677	S	S	*	*			trans	163.5	113.4	176.3	0	0	0	0	0	114.9	Y817 D818	G319-Y817 VanDerWaalsContact CA-O 3.27Å; G319-Y817 WeakPolarHBondContact CA-O 3.45Å; G319-D818 WeakPolarHBondContact CA-O 3.46Å
320	S	27.7	Very low	27.5	Very low	78 Å²	78	107 Å²	107	55%	0.545	68%	0.677	S	S	.	*			cis	-170	147.1	-0.3	62.7	0	0	0	0	116.3	D818 V819 D820	S320-D818 WeakPolarHBondContact CA-O 3.25Å; S320-D818 WeakPolarHBondContact CB-O 3.43Å; S320-V819 CarbonylContact C-O 3.41Å; S320-V819 VanDerWaalsContact CA-O 3.27Å; S320-V819 WeakPolarHBondContact CA-O 3.23Å; S320-D820 CarbonylContact C-O 3.55Å
321	T	27.5	Very low	27.5	Very low	89 Å²	89	105 Å²	105	55%	0.546	68%	0.681	S	S	.	*			trans	66.3	139.2	159.7	57.4	0	0	0	0	120.2	V819 D820 D821 R822	T321-V819 PolarHBondContact N-O 2.94Å; T321-D820 VanDerWaalsContact C-C 3.48Å; T321-D820 PolarHBondContact N-O 3.26Å; T321-D820 VanDerWaalsContact N-O 3.14Å; T321-D821 VanDerWaalsContact C-N 3.25Å; T321-D821 CarbonylContact O-C 3.46Å; T321-D821 WeakPolarHBondContact O-CA 3.29Å; T321-D821 PolarHBondContact O-N 3.03Å; T321-R822 PolarHBondContact O-N 3.01Å; T321-R822 VanDerWaalsContact O-N 3.17Å
322	M	27.9	Very low	27.6	Very low	90 Å²	90	102.7 Å²	102.7	44%	0.443	67%	0.674	S	S	.	*	B	Isolated β-bridge	cis	-130	-138.9	-0.6	-55.9	-177.3	-78.5	0	0	111	D820 D821 R822 E823	M322-D820 WeakPolarHBondContact O-CB 3.49Å; M322-D820 VanDerWaalsContact O-CG 3.25Å; M322-D821 CarbonylContact C-O 3.54Å; M322-D821 VanDerWaalsContact N-C 3.28Å; M322-D821 CarbonylContact O-C 3.57Å; M322-D821 VanDerWaalsContact O-C 3.29Å; M322-D821 PolarHBondContact O-N 2.92Å; M322-R822 HydrophobicContact CB-CB 3.81Å; M322-R822 HydrophobicContact CB-CG 4.3Å; M322-R822 HydrophobicContact CE-CB 4.44Å; M322-E823 HydrophobicContact CE-CG 4.19Å; M322-E823 WeakPolarHBondContact CE-OE1 3.3Å
323	G	28.4	Very low	27.5	Very low	42 Å²	42	102.8 Å²	102.8	43%	0.433	67%	0.67	S	S	.	*			cis	177.3	98	-13.6	0	0	0	0	0	116.4
324	G	27.9	Very low	27.5	Very low	81 Å²	81	105.2 Å²	105.2	84%	0.835	67%	0.67	S	S	*	*			trans	78.5	144.8	141.4	0	0	0	0	0	121.7
325	Q	26	Very low	27.4	Very low	190 Å²	190	107.1 Å²	107.1	89%	0.888	67%	0.672	S	S	*	*			cis	-161	-55.2	-11.5	-173.6	176.5	99.7	0	0	112.2
326	A	26.3	Very low	27.3	Very low	97 Å²	97	103.7 Å²	103.7	80%	0.802	67%	0.667	S	S	*	*			trans	62.2	150.4	175.6	0	0	0	0	0	119.7
327	S	25.6	Very low	27	Very low	99 Å²	99	103.1 Å²	103.1	69%	0.692	67%	0.672	S	S	*	*			trans	-180	163.4	173.3	49.6	0	0	0	0	112.1
328	T	26.1	Very low	27.3	Very low	114 Å²	114	103.1 Å²	103.1	70%	0.699	69%	0.688	S	S	*	*			trans	109.6	109.5	154.6	71.9	0	0	0	0	119.4
329	T	25.9	Very low	26.9	Very low	124 Å²	124	104.4 Å²	104.4	76%	0.761	70%	0.697	S	S	*	*				63.3	141.7	123.4	62.9	0	0	0	0	119
330	S	27	Very low	26.8	Very low	107 Å²	107	104.5 Å²	104.5	75%	0.748	70%	0.698	S	S	*	*			cis	169.7	124.3	3.6	45.2	0	0	0	0	106.3
331	G	27.8	Very low	26.5	Very low	78 Å²	78	109.3 Å²	109.3	80%	0.804	71%	0.709	S	S	*	*			trans	51.5	-177.9	157.9	0	0	0	0	0	119
332	P	31.3	Very low	26.5	Very low	103 Å²	103	110.6 Å²	110.6	67%	0.669	72%	0.716	S	S	*	*			cis	-126.4	155.8	-2.7	46.1	-31.4	0	0	0	111.3
333	Q	24.4	Very low	26.2	Very low	166 Å²	166	111.7 Å²	111.7	78%	0.776	73%	0.733	S	S	*	*				75.7	103.1	108.7	-71.6	175.2	3.8	0	0	114.8
334	T	26.8	Very low	26.1	Very low	127 Å²	127	113.2 Å²	113.2	78%	0.779	74%	0.741	S	S	*	*				59.6	105.7	92.7	65	0	0	0	0	113.5
335	S	25.8	Very low	26.1	Very low	107 Å²	107	116.5 Å²	116.5	75%	0.748	74%	0.738	S	S	*	*			trans	-179.8	107.6	137.3	47.4	0	0	0	0	105.6
336	A	25.1	Very low	26	Very low	87 Å²	87	113.5 Å²	113.5	72%	0.719	73%	0.733	S	S	*	*				64.9	149.8	75.4	0	0	0	0	0	112.1
337	T	23.2	Very low	26.1	Very low	110 Å²	110	113 Å²	113	68%	0.675	74%	0.737	S	S	*	*			trans	70.6	106.6	171.3	34.9	0	0	0	0	113.1	I339	T337-I339 HydrophobicContact CG2-CD1 4.37Å
338	S	32.8	Very low	26.1	Very low	101 Å²	101	111.1 Å²	111.1	71%	0.706	73%	0.734	S	S	*	*				48.8	156.6	64	96.8	0	0	0	0	111.4
339	I	24.2	Very low	26.1	Very low	141 Å²	141	111.3 Å²	111.3	72%	0.723	74%	0.74	S	S	*	*			trans	86	92.6	-168.9	-45.8	151	0	0	0	108.6	T337	T337-I339 HydrophobicContact CG2-CD1 4.37Å
340	G	24.6	Very low	26	Very low	64 Å²	64	110 Å²	110	66%	0.66	74%	0.736	S	S	*	*			cis	91.8	161.5	38.9	0	0	0	0	0	110
341	K	22	Very low	25.9	Very low	179 Å²	179	109.1 Å²	109.1	78%	0.778	73%	0.729	S	S	*	*			trans	74.4	91.1	164.8	-65.6	177.9	179.9	175.1	0	112.9
342	T	26.7	Very low	25.8	Very low	115 Å²	115	111.8 Å²	111.8	71%	0.706	73%	0.726	S	S	*	*				65.3	140.9	83.1	61.5	0	0	0	0	111.5
343	S	23	Very low	25.5	Very low	114 Å²	114	112.3 Å²	112.3	80%	0.797	73%	0.732	S	S	*	*			trans	70.8	137.8	155.6	65.6	0	0	0	0	114.7
344	A	24.9	Very low	25.5	Very low	73 Å²	73	108.2 Å²	108.2	60%	0.603	73%	0.726	S	S	*	*			cis	-179.9	-169.3	-1.8	0	0	0	0	0	105.7
345	I	27.9	Very low	25.4	Very low	150 Å²	150	108.4 Å²	108.4	77%	0.769	72%	0.722	S	S	*	*			trans	81.7	119.2	149	-61	147.1	0	0	0	113.1
346	T	25.5	Very low	25.4	Very low	127 Å²	127	109.3 Å²	109.3	78%	0.779	73%	0.728	S	S	*	*			cis	178.6	149	3.3	26.3	0	0	0	0	106
347	G	26.7	Very low	25.3	Very low	86 Å²	86	112.4 Å²	112.4	89%	0.887	73%	0.725	S	S	*	*			trans	81.1	120.6	146.8	0	0	0	0	0	115.8
348	G	27	Very low	25.3	Very low	61 Å²	61	109.8 Å²	109.8	63%	0.629	72%	0.72	S	S	*	*			cis	171.6	175.9	5.7	0	0	0	0	0	109.6
349	S	24.8	Very low	24.8	Very low	118 Å²	118	109.6 Å²	109.6	83%	0.825	72%	0.715	S	S	*	*			trans	61.9	122.1	151.1	33.3	0	0	0	0	115.7
350	S	25	Very low	24.8	Very low	97 Å²	97	108.3 Å²	108.3	68%	0.678	72%	0.718	S	S	*	*			cis	177.8	117.7	34.1	42.8	0	0	0	0	103.9
351	S	24.3	Very low	24.7	Very low	87 Å²	87	110.5 Å²	110.5	61%	0.608	71%	0.711	S	S	*	*				66.9	119.3	98.1	85.9	0	0	0	0	110.5
352	N	25.6	Very low	24.8	Very low	135 Å²	135	107.6 Å²	107.6	72%	0.722	71%	0.711	S	S	*	*				-177	150.2	61.6	-96.6	-43.4	0	0	0	108
353	S	25.6	Very low	24.4	Very low	114 Å²	114	106.3 Å²	106.3	80%	0.797	70%	0.702	S	S	*	*			trans	70.2	137.8	138.7	68.5	0	0	0	0	116.6
354	A	25.3	Very low	24.4	Very low	80 Å²	80	105.9 Å²	105.9	66%	0.661	70%	0.695	S	S	*	*			cis	174.1	170.3	0.8	0	0	0	0	0	104.8
355	L	24.5	Very low	24.3	Very low	131 Å²	131	108 Å²	108	69%	0.686	71%	0.705	S	S	*	*			trans	50.1	80.7	169.5	-87.9	63.7	0	0	0	113.4
356	S	24.2	Very low	24.1	Very low	126 Å²	126	106.3 Å²	106.3	88%	0.881	70%	0.698	S	S	*	*			cis	48.9	29.4	35.7	92.7	0	0	0	0	113.5
357	K	24	Very low	24	Very low	151 Å²	151	107.9 Å²	107.9	66%	0.657	70%	0.696	S	S	*	*			trans	-99.2	161.9	169.8	-126.5	-163.8	156.4	-152.5	0	108.8
358	G	23.6	Very low	23.9	Very low	56 Å²	56	108.7 Å²	108.7	58%	0.577	69%	0.686	S	S	*	*			cis	103.1	117.8	3.1	0	0	0	0	0	112
359	V	22.7	Very low	23.7	Very low	97 Å²	97	111.7 Å²	111.7	59%	0.588	69%	0.692	S	S	*	*			trans	89.9	97.5	-178.1	-167.5	0	0	0	0	112.2	E361	V359-E361 WeakPolarHBondContact CG1-O 3.07Å
360	S	22.3	Very low	23.6	Very low	114 Å²	114	109.9 Å²	109.9	80%	0.797	68%	0.679	S	S	*	*			cis	66.3	73.6	22.2	84.3	0	0	0	0	115
361	E	23.8	Very low	23.6	Very low	110 Å²	110	112.3 Å²	112.3	51%	0.514	69%	0.69	S	S	.	*			trans	62.6	173	179.3	-60.6	-133.8	70.6	0	0	113.3	V359 V363	V359-E361 WeakPolarHBondContact CG1-O 3.07Å; E361-V363 HydrophobicContact CB-CG2 4.18Å; E361-V363 PolarHBondContact OE1-N 3.3Å
362	P	23.3	Very low	23.6	Very low	117 Å²	117	111.9 Å²	111.9	76%	0.76	69%	0.692	S	S	*	*			cis	-60.9	154.4	18.4	-25.1	36.2	0	0	0	116.1
363	V	19.4	Very low	23.5	Very low	88 Å²	88	110.4 Å²	110.4	53%	0.533	69%	0.692	S	S	.	*			cis	67.3	106.4	37.3	168.2	0	0	0	0	113.1	E361	E361-V363 HydrophobicContact CB-CG2 4.18Å; E361-V363 PolarHBondContact OE1-N 3.3Å
364	V	22.9	Very low	23.3	Very low	106 Å²	106	110.6 Å²	110.6	64%	0.642	69%	0.688	S	S	*	*			trans	72.1	83	135	-178	0	0	0	0	115.9	N366	V364-N366 HydrophobicContact CG1-CB 4.23Å; V364-N366 VanDerWaalsContact CG1-ND2 3.32Å; V364-N366 WeakPolarHBondContact CG1-ND2 3.48Å
365	S	22.1	Very low	23.1	Very low	117 Å²	117	112.3 Å²	112.3	82%	0.818	69%	0.69	S	S	*	*				-97.1	139.5	120.3	31.5	0	0	0	0	107.2
366	N	23.7	Very low	23	Very low	115 Å²	115	117.6 Å²	117.6	62%	0.615	70%	0.701	S	S	*	*			cis	62	132.8	5.4	-71.9	-5.1	0	0	0	115.9	V364	V364-N366 HydrophobicContact CG1-CB 4.23Å; V364-N366 VanDerWaalsContact CG1-ND2 3.32Å; V364-N366 WeakPolarHBondContact CG1-ND2 3.48Å
367	Q	24.1	Very low	22.9	Very low	160 Å²	160	114.5 Å²	114.5	75%	0.748	69%	0.689	S	S	*	*			cis	-176	176.3	0.2	-117.5	-173.1	11.3	0	0	108.3
368	P	24.5	Very low	22.8	Very low	103 Å²	103	114.1 Å²	114.1	67%	0.669	70%	0.7	S	S	*	*			cis	-133.7	-4.6	-6.7	23.6	-0.7	0	0	0	117.1
369	V	22.4	Very low	22.8	Very low	123 Å²	123	119.9 Å²	119.9	75%	0.745	71%	0.709	S	S	*	*			trans	-136.8	146.8	-149.8	154.6	0	0	0	0	110.5
370	S	22.9	Very low	22.9	Very low	81 Å²	81	119.1 Å²	119.1	57%	0.566	70%	0.701	S	S	*	*			cis	-175.8	125.5	-17.2	-76.4	0	0	0	0	103.3
371	T	25.2	Very low	23.1	Very low	147 Å²	147	118.3 Å²	118.3	90%	0.902	68%	0.684	S	S	*	*				37.5	81.1	93	-3.6	0	0	0	0	113.2
372	A	23.9	Very low	23.2	Very low	78 Å²	78	117.2 Å²	117.2	65%	0.645	68%	0.681	S	S	*	*			trans	-172.8	114.5	157.3	0	0	0	0	0	106.3
373	S	22.3	Very low	23.3	Very low	104 Å²	104	113.5 Å²	113.5	73%	0.727	66%	0.656	S	S	*	*				62.6	155.8	66.2	80.1	0	0	0	0	111.9
374	V	21.9	Very low	23.4	Very low	118 Å²	118	112.5 Å²	112.5	72%	0.715	65%	0.65	S	S	*	*			trans	83.7	86.8	170.9	-169.5	0	0	0	0	112.9
375	T	22.4	Very low	23.4	Very low	116 Å²	116	112.5 Å²	112.5	71%	0.712	64%	0.643	S	S	*	*				65.4	143.2	90.1	66.6	0	0	0	0	115.7
376	R	21.1	Very low	23.4	Very low	242 Å²	242	111.1 Å²	111.1	91%	0.913	63%	0.633	S	S	*	*			trans	76.9	114.5	162	-69.9	174.1	167.7	158.8	-3.1	117.3
377	G	21.4	Very low	23.5	Very low	61 Å²	61	110.9 Å²	110.9	63%	0.629	64%	0.641	S	S	*	*				62.5	126.2	114	0	0	0	0	0	119.7
378	T	22.7	Very low	23.4	Very low	143 Å²	143	109.1 Å²	109.1	88%	0.877	64%	0.636	S	S	*	*				79.3	153.3	128.4	55.7	0	0	0	0	121.7
379	K	23.1	Very low	23.5	Very low	177 Å²	177	112.8 Å²	112.8	77%	0.77	64%	0.641	S	S	*	*			trans	72.4	156.7	170.1	-95.3	-164.8	174.3	-78.3	0	116.9
380	D	25.4	Very low	23.5	Very low	81 Å²	81	111.7 Å²	111.7	43%	0.433	64%	0.637	S	S	.	*			cis	-132.7	169.6	-10.4	-157.8	18.4	0	0	0	113	T1134	D380-T1134 WeakPolarHBondContact O-CG2 3.37Å
381	K	25.5	Very low	23.5	Very low	97 Å²	97	111.3 Å²	111.3	42%	0.422	64%	0.639	S	S	.	*			trans	-61.2	154.4	168.5	61.1	83	-141.7	56.9	0	112.2	T1132	K381-T1132 HydrophobicContact CB-CG2 3.59Å; K381-T1132 HydrophobicContact CG-CG2 3.78Å
382	L	27.5	Very low	23.3	Very low	88 Å²	88	113.8 Å²	113.8	46%	0.461	64%	0.637	S	S	.	*			trans	-158.9	121.9	174.6	-171.8	63	0	0	0	112.1	T384 T1134 T1135	L382-T384 VanDerWaalsContact C-N 3.34Å; L382-T384 PolarHBondContact O-N 3.03Å; L382-T1134 HydrophobicContact CB-CG2 4.1Å; L382-T1134 WeakPolarHBondContact O-CA 3.22Å; L382-T1135 HydrophobicContact CB-CG2 4.29Å; L382-T1135 HydrophobicContact CD2-CG2 3.9Å; L382-T1135 HydrophobicContact CG-CG2 4.48Å; L382-T1135 WeakPolarHBondContact O-CA 3.37Å
383	T	23.8	Very low	23.2	Very low	39 Å²	39	115.9 Å²	115.9	24%	0.239	65%	0.647	C	S	.	*			trans	20.9	40.1	151.7	62.1	0	0	0	0	122.3	H717 Q1136	T383-H717 WeakPolarHBondContact CG2-CE1 3.46Å; T383-H717 VanDerWaalsContact CG2-NE2 3.34Å; T383-H717 WeakPolarHBondContact CG2-NE2 3.43Å; T383-Q1136 VanDerWaalsContact CB-OE1 3.24Å; T383-Q1136 WeakPolarHBondContact O-CA 2.95Å; T383-Q1136 VanDerWaalsContact O-CB 3.25Å; T383-Q1136 WeakPolarHBondContact O-CB 3.27Å; T383-Q1136 PolarHBondContact O-N 3Å; T383-Q1136 WeakPolarHBondContact OG1-CB 3.43Å; T383-Q1136 PolarHBondContact OG1-OE1 3.45Å
384	T	22.8	Very low	23.2	Very low	66 Å²	66	114.4 Å²	114.4	41%	0.405	65%	0.648	S	S	.	*			trans	-58.2	133.4	178.6	41.2	0	0	0	0	115.7	L382 T1134 T1135	L382-T384 VanDerWaalsContact C-N 3.34Å; L382-T384 PolarHBondContact O-N 3.03Å; T384-T1134 VanDerWaalsContact CG2-N 3.26Å; T384-T1135 WeakPolarHBondContact CA-O 3.37Å; T384-T1135 VanDerWaalsContact CG2-N 3.31Å
385	E	22.8	Very low	23.2	Very low	106 Å²	106	115.1 Å²	115.1	50%	0.495	64%	0.642	S	S	.	*			trans	-111.6	85.1	151	-66.7	-159.2	173	0	0	109.7
386	S	22.9	Very low	23.2	Very low	88 Å²	88	114.5 Å²	114.5	62%	0.615	64%	0.642	S	S	*	*				60.8	112.3	84.2	74.9	0	0	0	0	111.7
387	S	24	Very low	23.3	Very low	110 Å²	110	109.9 Å²	109.9	77%	0.769	64%	0.64	S	S	*	*				-167.2	111.7	79.2	-162.2	0	0	0	0	109.4
388	L	23.7	Very low	23.4	Very low	123 Å²	123	110 Å²	110	64%	0.644	64%	0.641	S	S	*	*				51.7	103.2	101.3	-84.6	89.9	0	0	0	115.9	V1128	L388-V1128 HydrophobicContact CD2-CG2 4.14Å
389	K	25.3	Very low	23.5	Very low	180 Å²	180	108 Å²	108	78%	0.783	63%	0.633	S	S	*	*				29.4	149.5	107.7	-90.9	-175.6	-174.6	178.9	0	117.5	A391	K389-A391 HydrophobicContact CD-CB 4.16Å; K389-A391 HydrophobicContact CG-CB 4.31Å
390	P	23	Very low	23.7	Very low	101 Å²	101	109 Å²	109	66%	0.656	64%	0.641	S	S	*	*				-146.7	129.2	54.8	35.7	-14.1	0	0	0	115.5
391	A	22	Very low	24.2	Very low	73 Å²	73	110.8 Å²	110.8	60%	0.603	65%	0.647	S	S	*	*				42.3	89.5	86.1	0	0	0	0	0	114.2	K389	K389-A391 HydrophobicContact CD-CB 4.16Å; K389-A391 HydrophobicContact CG-CB 4.31Å
392	K	22.8	Very low	25.3	Very low	198 Å²	198	113 Å²	113	86%	0.861	66%	0.658	S	S	*	*			trans	-135.5	93.1	145	-80.8	-169.6	179.5	174.5	0	111.2
393	S	21.4	Very low	26.5	Very low	122 Å²	122	113.6 Å²	113.6	85%	0.853	66%	0.661	S	S	*	*			trans	27.9	107	141.8	64.3	0	0	0	0	119.4
394	G	22.3	Very low	28.7	Very low	74 Å²	74	116.3 Å²	116.3	76%	0.763	67%	0.674	S	S	*	*			trans	-176.7	92.2	156.8	0	0	0	0	0	110.7	S396	G394-S396 PolarHBondContact O-N 3Å
395	K	22.1	Very low	31.1	Very low	133 Å²	133	113.8 Å²	113.8	58%	0.578	66%	0.658	S	S	*	*			trans	10.6	100.2	159.4	-62.1	175.5	178.3	179	0	115.7	D2107 T2108	K395-D2107 IonicContact NZ-OD1 2.91Å; K395-D2107 PolarHBondContact NZ-OD1 3.38Å; K395-T2108 WeakPolarHBondContact CE-OG1 3.4Å; K395-T2108 PolarHBondContact NZ-OG1 2.95Å; K395-T2108 VanDerWaalsContact NZ-OG1 3.15Å
396	S	21	Very low	33.8	Very low	103 Å²	103	110 Å²	110	72%	0.72	64%	0.642	S	S	*	*				67.8	137.8	85.2	73.5	0	0	0	0	116.6	G394	G394-S396 PolarHBondContact O-N 3Å
397	V	23.7	Very low	36.7	Very low	144 Å²	144	106.4 Å²	106.4	87%	0.873	62%	0.616	S	S	*	*			trans	94.9	117.5	177.3	-169.6	0	0	0	0	112.2
398	G	24.7	Very low	39.8	Very low	63 Å²	63	101.2 Å²	101.2	65%	0.649	58%	0.58	S	S	*	*			cis	-157.6	165.7	6.6	0	0	0	0	0	109.8
399	S	24.6	Very low	43	Very low	101 Å²	101	95.4 Å²	95.4	71%	0.706	55%	0.549	S	S	*	.			trans	-45.8	144.7	174.2	41.5	0	0	0	0	113.5	E401	S399-E401 PolarHBondContact O-N 2.98Å
400	E	27.2	Very low	46.1	Very low	199 Å²	199	87 Å²	87	93%	0.93	51%	0.513	S	S	*	.			trans	-40.2	102.9	166.3	-67.4	174.6	158.9	0	0	110
401	E	36.2	Very low	49.4	Very low	118 Å²	118	82.1 Å²	82.1	55%	0.551	48%	0.482	S	S	*	.			trans	-76.2	128.5	-178.9	-85.5	170.5	167.6	0	0	109	S399 I403 Q541	S399-E401 PolarHBondContact O-N 2.98Å; E401-I403 PolarHBondContact O-N 3.43Å; E401-I403 VanDerWaalsContact O-N 3.15Å; E401-Q541 PolarHBondContact OE1-NE2 3.04Å
402	E	47.4	Very low	52.5	Low	143 Å²	143	78.7 Å²	78.7	67%	0.668	45%	0.453	S	S	*	.			trans	-68.5	103.3	178.4	-67.1	173.5	149.4	0	0	109.7	L404	E402-L404 PolarHBondContact O-N 3.41Å
403	I	53.5	Low	55.5	Low	101 Å²	101	69.3 Å²	69.3	52%	0.518	41%	0.413	S	S	.	.			trans	-71.4	114.5	179.6	-59.5	153	0	0	0	109.6	N267 E401 E548	N267-I403 PolarHBondContact OD1-O 3.06Å; E401-I403 PolarHBondContact O-N 3.43Å; E401-I403 VanDerWaalsContact O-N 3.15Å; I403-E548 WeakPolarHBondContact CD1-OE1 3.37Å
404	L	68.7	Low	58.4	Low	96 Å²	96	63.6 Å²	63.6	50%	0.503	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-78.6	142.1	174.8	-64.1	165.4	0	0	0	110.4	L265 E402	L265-L404 HydrophobicContact CD2-CD2 3.41Å; L265-L404 VanDerWaalsContact CD2-CD2 3.41Å; L265-L404 HydrophobicContact CG-CD2 4.2Å; E402-L404 PolarHBondContact O-N 3.41Å
405	V	74.8	Confident	61.2	Low	13 Å²	13	60.9 Å²	60.9	8%	0.079	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-69.1	125.2	169.6	-177.3	0	0	0	0	108.4	P100 I103 S264	P100-V405 HydrophobicContact CB-CG1 4.42Å; P100-V405 HydrophobicContact CG-CG1 4.17Å; P100-V405 VanDerWaalsContact O-CG1 3.31Å; P100-V405 WeakPolarHBondContact O-CG1 3.26Å; P100-V405 WeakPolarHBondContact O-CG2 3.42Å; I103-V405 HydrophobicContact CD1-CB 4.35Å; I103-V405 HydrophobicContact CD1-CG1 4.1Å; I103-V405 HydrophobicContact CG1-CG1 3.97Å; S264-V405 PolarHBondContact O-N 3.45Å; S264-V405 PolarHBondContact OG-O 3.32Å
406	P	78.8	Confident	64	Low	26 Å²	26	56.4 Å²	56.4	17%	0.169	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-64.3	142.7	179.9	25.5	-33.3	0	0	0	111.1	T101 L102 I103 L529	T101-P406 WeakPolarHBondContact O-CD 3.46Å; T101-P406 WeakPolarHBondContact O-CG 3.27Å; L102-P406 HydrophobicContact CD1-CB 4.3Å; L102-P406 HydrophobicContact CD1-CG 4.19Å; I103-P406 PolarHBondContact N-O 3.06Å; P406-L529 HydrophobicContact CB-CD2 3.95Å
407	M	84.6	Confident	67	Low	14 Å²	14	53.7 Å²	53.7	7%	0.069	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.1	-179.4	-176.8	-170.4	-53.5	0	0	109.6	I103 E260 N429 C431 P432 L529	I103-M407 HydrophobicContact CB-CB 4.25Å; I103-M407 HydrophobicContact CB-CG 4.14Å; I103-M407 HydrophobicContact CD1-CE 4.17Å; I103-M407 HydrophobicContact CG2-CG 4.15Å; I103-M407 WeakPolarHBondContact O-CA 3.17Å; E260-M407 VanDerWaalsContact C-CE 3.44Å; E260-M407 HydrophobicContact CB-CE 3.6Å; E260-M407 HydrophobicContact CB-SD 3.89Å; E260-M407 HydrophobicContact CG-CE 4.47Å; E260-M407 HydrophobicContact CG-SD 4.32Å; E260-M407 WeakPolarHBondContact O-CE 3.3Å; M407-N429 HydrophobicContact SD-CB 4.48Å; M407-C431 HydrophobicContact SD-CB 4.1Å; M407-P432 VanDerWaalsContact O-CD 3.23Å; M407-P432 WeakPolarHBondContact O-CD 3.48Å; M407-P432 WeakPolarHBondContact O-CG 3.41Å; M407-L529 WeakPolarHBondContact O-CD2 3.27Å
408	C	88.7	Confident	70	Confident	1 Å²	1	47 Å²	47	1%	0.007	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.3	173.4	-178	0	0	0	0	109.6	I103 I104 T105 P432 V525 S528 L529	I103-C408 PolarHBondContact O-N 3.41Å; I104-C408 WeakPolarHBondContact CA-O 3.03Å; T105-C408 PolarHBondContact N-O 3.38Å; C408-P432 WeakPolarHBondContact CA-O 3.37Å; C408-V525 HydrophobicContact CB-CG1 4.06Å; C408-S528 PolarHBondContact SG-OG 3.06Å; C408-S528 VanDerWaalsContact SG-OG 3.37Å; C408-L529 HydrophobicContact CB-CD1 4.4Å; C408-L529 HydrophobicContact CB-CD2 3.82Å; C408-L529 HydrophobicContact CB-CG 3.99Å
409	G	89.5	Confident	73	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	140.9	172.7	0	0	0	0	0	111.9	T105 C431 P432 I433 V434	T105-G409 VanDerWaalsContact CG2-CA 3.42Å; T105-G409 CarbonylContact O-C 3.59Å; T105-G409 WeakPolarHBondContact O-CA 3.45Å; G409-C431 PolarHBondContact N-SG 2.79Å; G409-C431 VanDerWaalsContact N-SG 3.4Å; G409-P432 PolarHBondContact N-O 3.26Å; G409-I433 CarbonylContact O-C 3.56Å; G409-I433 WeakPolarHBondContact O-CA 3.24Å; G409-V434 PolarHBondContact O-N 2.92Å
410	L	91.6	Very high	75.9	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.3	176.8	-179.4	62.2	0	0	0	108.2	T105 F107 F121 V412 V434 T436 L521	T105-L410 PolarHBondContact O-N 3.19Å; F107-L410 PolarHBondContact N-O 3.43Å; F121-L410 HydrophobicContact CD2-CD2 4.11Å; F121-L410 HydrophobicContact CE2-CD2 3.49Å; F121-L410 VanDerWaalsContact CE2-CD2 3.49Å; F121-L410 HydrophobicContact CE2-CG 4.45Å; F121-L410 HydrophobicContact CZ-CD2 4.45Å; L410-V412 HydrophobicContact CD1-CG2 4.48Å; L410-V412 HydrophobicContact CD2-CG2 4.37Å; L410-V412 HydrophobicContact CG-CG2 3.99Å; L410-V434 WeakPolarHBondContact CA-O 3.09Å; L410-V434 HydrophobicContact CD1-CB 3.99Å; L410-V434 HydrophobicContact CD1-CG1 4.02Å; L410-T436 HydrophobicContact CD1-CG2 3.65Å; L410-L521 HydrophobicContact CD1-CD1 3.88Å; L410-L521 HydrophobicContact CD2-CD2 4.14Å
411	V	91.8	Very high	78.8	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	115.5	-179.1	-174.8	0	0	0	0	108.6	F107 T418 V422 I433 V434 T436 A443 L446	F107-V411 HydrophobicContact CB-CG2 4.19Å; F107-V411 HydrophobicContact CD2-CG2 4.09Å; F107-V411 WeakPolarHBondContact O-CA 3.46Å; V411-T418 HydrophobicContact CG1-CG2 4.32Å; V411-V422 HydrophobicContact CG2-CG2 3.43Å; V411-V422 VanDerWaalsContact CG2-CG2 3.43Å; V411-I433 HydrophobicContact CG2-CG2 3.44Å; V411-I433 VanDerWaalsContact CG2-CG2 3.44Å; V411-V434 PolarHBondContact N-O 3.37Å; V411-T436 PolarHBondContact O-N 3.02Å; V411-T436 PolarHBondContact O-OG1 3.41Å; V411-A443 HydrophobicContact CG1-CB 4.06Å; V411-L446 HydrophobicContact CG1-CD1 4.47Å
412	V	88.3	Confident	81.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.148	C	C	.	.			trans	-125.2	119	178.9	-175.8	0	0	0	0	108.6	F107 G108 F111 F121 V144 L410 T436 T439	F107-V412 PolarHBondContact O-N 2.85Å; G108-V412 WeakPolarHBondContact CA-O 3.33Å; F111-V412 HydrophobicContact CD1-CG1 3.81Å; F111-V412 HydrophobicContact CE1-CG1 3.73Å; F111-V412 HydrophobicContact CG-CG1 4.3Å; F111-V412 HydrophobicContact CZ-CG1 4.18Å; F121-V412 HydrophobicContact CD2-CG2 4.08Å; F121-V412 HydrophobicContact CE2-CG2 3.73Å; V144-V412 HydrophobicContact CG1-CB 4.24Å; V144-V412 HydrophobicContact CG2-CB 3.72Å; V144-V412 HydrophobicContact CG2-CG1 3.63Å; L410-V412 HydrophobicContact CD1-CG2 4.48Å; L410-V412 HydrophobicContact CD2-CG2 4.37Å; L410-V412 HydrophobicContact CG-CG2 3.99Å; V412-T436 WeakPolarHBondContact CA-OG1 3.4Å; V412-T436 HydrophobicContact CG2-CG2 3.95Å; V412-T439 HydrophobicContact CG1-CG2 3.98Å
413	G	84.2	Confident	83.3	Confident	1 Å²	1	27 Å²	27	1%	0.01	13%	0.126	C	C	.	.	S	Bend	trans	62.5	-136.9	-174.3	0	0	0	0	0	111.9	T439 S440 A443	G413-T439 WeakPolarHBondContact CA-O 3.13Å; G413-T439 PolarHBondContact N-OG1 2.86Å; G413-S440 CarbonylContact C-O 3.21Å; G413-S440 VanDerWaalsContact CA-O 3.25Å; G413-S440 WeakPolarHBondContact CA-O 3.42Å; G413-A443 WeakPolarHBondContact O-CB 3.24Å; G413-A443 PolarHBondContact O-N 3.42Å
414	G	82.4	Confident	84.9	Confident	2 Å²	2	22.9 Å²	22.9	2%	0.021	11%	0.107	C	C	.	.			trans	108.8	156.8	168.6	0	0	0	0	0	114.4	T109 T418 G441 A442	T109-G414 VanDerWaalsContact OG1-CA 3.3Å; T109-G414 WeakPolarHBondContact OG1-CA 3.49Å; G414-T418 WeakPolarHBondContact CA-OG1 3.37Å; G414-G441 CarbonylContact O-C 3.58Å; G414-G441 VanDerWaalsContact O-CA 3.29Å; G414-G441 WeakPolarHBondContact O-CA 3.45Å; G414-A442 PolarHBondContact O-N 3.1Å
415	D	81.4	Confident	85.7	Confident	17 Å²	17	18.4 Å²	18.4	9%	0.091	8%	0.083	C	C	.	.			trans	-105.8	-173	176.7	60.8	9.3	0	0	0	111.1	T109 F417 T418 L419	T109-D415 HydrophobicContact CG2-CB 4.32Å; D415-F417 PolarHBondContact O-N 2.74Å; D415-F417 WeakPolarHBondContact OD1-CB 3.46Å; D415-F417 PolarHBondContact OD1-N 2.87Å; D415-F417 VanDerWaalsContact OD1-N 3.1Å; D415-F417 WeakPolarHBondContact OD2-CD2 3.04Å; D415-T418 PolarHBondContact N-OG1 2.97Å; D415-T418 VanDerWaalsContact N-OG1 3.13Å; D415-T418 VanDerWaalsContact O-CB 3.24Å; D415-T418 WeakPolarHBondContact O-CB 3.48Å; D415-T418 PolarHBondContact O-N 3Å; D415-T418 VanDerWaalsContact O-N 3.09Å; D415-T418 PolarHBondContact OD1-N 2.87Å; D415-T418 PolarHBondContact OD1-OG1 3.07Å; D415-L419 PolarHBondContact O-N 2.87Å
416	R	82.1	Confident	86.2	Confident	40 Å²	40	17.8 Å²	17.8	15%	0.151	8%	0.079	C	C	.	.	H	α-helix	trans	-59.2	-29.7	175.8	66	-178.6	-62.5	-150.8	-2.3	114	L419 R420 Y489 E495	R416-L419 PolarHBondContact O-N 3.33Å; R416-R420 PolarHBondContact O-N 3.37Å; R416-Y489 VanDerWaalsContact NH1-CE1 3.33Å; R416-Y489 VanDerWaalsContact NH1-CG 3.31Å; R416-Y489 PolarHBondContact NH2-OH 3.29Å; R416-E495 HydrophobicContact CB-CG 4.46Å; R416-E495 IonicContact CZ-OE1 3.49Å; R416-E495 IonicContact NE-OE1 2.72Å; R416-E495 PolarHBondContact NE-OE1 3.14Å; R416-E495 IonicContact NH2-OE1 2.78Å; R416-E495 PolarHBondContact NH2-OE1 3.28Å; R416-E495 IonicContact NH2-OE2 2.85Å
417	F	82.3	Confident	86.4	Confident	46 Å²	46	19.1 Å²	19.1	20%	0.202	9%	0.085	C	C	.	.	H	α-helix	trans	-73.9	-31.6	177.7	-56.5	-71.8	0	0	0	111.2	K249 D415 L419 R420 Q421	K249-F417 HydrophobicContact CB-CD1 4.47Å; K249-F417 HydrophobicContact CB-CE1 4Å; K249-F417 HydrophobicContact CB-CE2 4.12Å; K249-F417 HydrophobicContact CB-CZ 3.81Å; K249-F417 HydrophobicContact CD-CE2 4.48Å; K249-F417 VanDerWaalsContact O-CE1 3.3Å; K249-F417 WeakPolarHBondContact O-CE1 3.46Å; D415-F417 PolarHBondContact O-N 2.74Å; D415-F417 WeakPolarHBondContact OD1-CB 3.46Å; D415-F417 PolarHBondContact OD1-N 2.87Å; D415-F417 VanDerWaalsContact OD1-N 3.1Å; D415-F417 WeakPolarHBondContact OD2-CD2 3.04Å; F417-L419 VanDerWaalsContact C-N 3.35Å; F417-R420 WeakPolarHBondContact O-CB 3.43Å; F417-R420 PolarHBondContact O-N 2.87Å; F417-Q421 WeakPolarHBondContact O-CG 3.18Å; F417-Q421 PolarHBondContact O-N 3.19Å
418	T	87.5	Confident	86.2	Confident	4 Å²	4	22.8 Å²	22.8	3%	0.025	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-43.6	172.6	-52.4	0	0	0	0	110.7	F107 V411 G414 D415 R420 Q421 V422 A442	F107-T418 HydrophobicContact CB-CG2 3.81Å; V411-T418 HydrophobicContact CG1-CG2 4.32Å; G414-T418 WeakPolarHBondContact CA-OG1 3.37Å; D415-T418 PolarHBondContact N-OG1 2.97Å; D415-T418 VanDerWaalsContact N-OG1 3.13Å; D415-T418 VanDerWaalsContact O-CB 3.24Å; D415-T418 WeakPolarHBondContact O-CB 3.48Å; D415-T418 PolarHBondContact O-N 3Å; D415-T418 VanDerWaalsContact O-N 3.09Å; D415-T418 PolarHBondContact OD1-N 2.87Å; D415-T418 PolarHBondContact OD1-OG1 3.07Å; T418-R420 VanDerWaalsContact C-N 3.32Å; T418-R420 PolarHBondContact O-N 3.4Å; T418-Q421 PolarHBondContact O-N 3.24Å; T418-V422 WeakPolarHBondContact O-CG2 3.48Å; T418-V422 PolarHBondContact O-N 3.21Å; T418-A442 HydrophobicContact CG2-CB 4.45Å
419	L	86.6	Confident	85.8	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-61.3	-39.3	175.6	-166.7	141.5	0	0	0	111.9	D415 R416 F417 V422 Y423 A442 V445 E495 M498	D415-L419 PolarHBondContact O-N 2.87Å; R416-L419 PolarHBondContact O-N 3.33Å; F417-L419 VanDerWaalsContact C-N 3.35Å; L419-V422 PolarHBondContact O-N 3.38Å; L419-Y423 WeakPolarHBondContact O-CB 3.42Å; L419-Y423 PolarHBondContact O-N 3.15Å; L419-A442 HydrophobicContact CB-CB 4.41Å; L419-V445 HydrophobicContact CD1-CG1 4.17Å; L419-E495 HydrophobicContact CD2-CB 4.31Å; L419-E495 HydrophobicContact CD2-CG 4.39Å; L419-M498 HydrophobicContact CD2-CB 3.85Å; L419-M498 HydrophobicContact CD2-CE 3.81Å; L419-M498 HydrophobicContact CD2-SD 4.22Å
420	R	87	Confident	85.3	Confident	122 Å²	122	30.8 Å²	30.8	46%	0.46	13%	0.131	S	C	.	.	H	α-helix	trans	-66.6	-39	173.9	-173.2	176.4	-177.7	173	2.4	113.3	R416 F417 T418 Y423 C424 M498	R416-R420 PolarHBondContact O-N 3.37Å; F417-R420 WeakPolarHBondContact O-CB 3.43Å; F417-R420 PolarHBondContact O-N 2.87Å; T418-R420 VanDerWaalsContact C-N 3.32Å; T418-R420 PolarHBondContact O-N 3.4Å; R420-Y423 PolarHBondContact O-N 2.84Å; R420-C424 PolarHBondContact O-N 3.46Å; R420-C424 PolarHBondContact O-SG 2.93Å; R420-M498 HydrophobicContact CB-SD 4.43Å; R420-M498 HydrophobicContact CG-SD 4.48Å
421	Q	88	Confident	84.9	Confident	22 Å²	22	30.8 Å²	30.8	10%	0.103	13%	0.13	C	C	.	.	H	α-helix	trans	-62.5	-45.3	174.7	-72.5	179.5	7.6	0	0	110.8	F107 E252 A253 F417 T418 C424 S425	F107-Q421 HydrophobicContact CD1-CB 3.78Å; F107-Q421 HydrophobicContact CE1-CB 3.86Å; E252-Q421 PolarHBondContact OE1-NE2 2.84Å; A253-Q421 HydrophobicContact CB-CB 4.48Å; A253-Q421 HydrophobicContact CB-CG 3.82Å; F417-Q421 WeakPolarHBondContact O-CG 3.18Å; F417-Q421 PolarHBondContact O-N 3.19Å; T418-Q421 PolarHBondContact O-N 3.24Å; Q421-C424 PolarHBondContact O-N 3.07Å; Q421-S425 PolarHBondContact O-N 2.94Å
422	V	88.6	Confident	84.7	Confident	1 Å²	1	31 Å²	31	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-59.5	-48.4	175.8	172.4	0	0	0	0	111.2	F107 V411 T418 L419 C424 S425 M426 I433 L446	F107-V422 HydrophobicContact CB-CG2 4.24Å; F107-V422 HydrophobicContact CD2-CG2 3.96Å; F107-V422 HydrophobicContact CE2-CG2 4.44Å; F107-V422 HydrophobicContact CG-CG2 4.04Å; V411-V422 HydrophobicContact CG2-CG2 3.43Å; V411-V422 VanDerWaalsContact CG2-CG2 3.43Å; T418-V422 WeakPolarHBondContact O-CG2 3.48Å; T418-V422 PolarHBondContact O-N 3.21Å; L419-V422 PolarHBondContact O-N 3.38Å; V422-C424 PolarHBondContact O-N 3.32Å; V422-S425 PolarHBondContact O-N 3.12Å; V422-M426 HydrophobicContact CG1-CE 3.73Å; V422-M426 HydrophobicContact CG1-CG 4.39Å; V422-M426 HydrophobicContact CG1-SD 4.26Å; V422-M426 WeakPolarHBondContact O-CB 3.25Å; V422-M426 WeakPolarHBondContact O-CG 3.43Å; V422-M426 PolarHBondContact O-N 3.44Å; V422-I433 HydrophobicContact CG1-CG1 4.18Å; V422-I433 HydrophobicContact CG1-CG2 4.32Å; V422-L446 HydrophobicContact CG1-CD1 4.32Å
423	Y	88.7	Confident	84.7	Confident	56 Å²	56	31 Å²	31	22%	0.22	13%	0.132	C	C	.	.	H	α-helix	trans	-57.1	-45.8	176.4	175.9	-96.5	0	0	0	112.3	L419 R420 S425 M426 I427 M498 E501 I502	L419-Y423 WeakPolarHBondContact O-CB 3.42Å; L419-Y423 PolarHBondContact O-N 3.15Å; R420-Y423 PolarHBondContact O-N 2.84Å; Y423-S425 PolarHBondContact O-N 3.3Å; Y423-M426 PolarHBondContact O-N 3.28Å; Y423-I427 HydrophobicContact CD1-CD1 4.05Å; Y423-I427 HydrophobicContact CD2-CD1 3.66Å; Y423-I427 HydrophobicContact CE1-CD1 3.58Å; Y423-I427 HydrophobicContact CE2-CD1 3.15Å; Y423-I427 HydrophobicContact CE2-CG1 4.4Å; Y423-I427 HydrophobicContact CG-CD1 4.08Å; Y423-I427 PolarHBondContact O-N 3.31Å; Y423-I427 WeakPolarHBondContact OH-CD1 3.48Å; Y423-M498 HydrophobicContact CD1-CG 4.15Å; Y423-M498 HydrophobicContact CD1-SD 3.91Å; Y423-M498 HydrophobicContact CD2-CB 3.75Å; Y423-M498 HydrophobicContact CD2-CG 3.7Å; Y423-M498 HydrophobicContact CD2-SD 4.31Å; Y423-M498 HydrophobicContact CE1-CG 4.28Å; Y423-M498 HydrophobicContact CE1-SD 4.44Å; Y423-M498 HydrophobicContact CE2-CB 4.09Å; Y423-M498 HydrophobicContact CE2-CG 3.82Å; Y423-M498 HydrophobicContact CG-CB 4.22Å; Y423-M498 HydrophobicContact CG-CG 3.86Å; Y423-M498 HydrophobicContact CG-SD 3.84Å; Y423-E501 HydrophobicContact CE2-CB 4.46Å; Y423-E501 PolarHBondContact OH-OE2 2.92Å; Y423-E501 VanDerWaalsContact OH-OE2 3.08Å; Y423-I502 HydrophobicContact CD2-CD1 4.3Å; Y423-I502 HydrophobicContact CD2-CG1 4.32Å
424	C	86.8	Confident	85	Confident	16 Å²	16	31 Å²	31	11%	0.108	13%	0.131	C	C	.	.	H	α-helix	trans	-63.3	-43.1	178	-69.8	0	0	0	0	112.7	A253 A257 R420 Q421 V422 R428	A253-C424 HydrophobicContact CB-CB 4.4Å; A257-C424 HydrophobicContact CB-CB 4.47Å; R420-C424 PolarHBondContact O-N 3.46Å; R420-C424 PolarHBondContact O-SG 2.93Å; Q421-C424 PolarHBondContact O-N 3.07Å; V422-C424 PolarHBondContact O-N 3.32Å; C424-R428 VanDerWaalsContact O-CB 3.24Å; C424-R428 WeakPolarHBondContact O-CB 3.21Å; C424-R428 VanDerWaalsContact O-CG 3.31Å; C424-R428 WeakPolarHBondContact O-CG 3.41Å; C424-R428 PolarHBondContact O-N 2.63Å; C424-R428 VanDerWaalsContact O-N 3.11Å
425	S	85.7	Confident	85.4	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-71.3	-35.7	178.9	-71	0	0	0	0	112.4	E260 Q421 V422 Y423 N429	E260-S425 PolarHBondContact OE2-OG 3.21Å; Q421-S425 PolarHBondContact O-N 2.94Å; V422-S425 PolarHBondContact O-N 3.12Å; Y423-S425 PolarHBondContact O-N 3.3Å; S425-N429 WeakPolarHBondContact O-CB 3.33Å; S425-N429 PolarHBondContact O-N 2.78Å; S425-N429 VanDerWaalsContact O-N 3.13Å
426	M	85.4	Confident	85.7	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.1	-51.3	174.4	-76.8	-171.7	-178.4	0	0	111.9	V422 Y423 R430 I433 I502 V510	V422-M426 HydrophobicContact CG1-CE 3.73Å; V422-M426 HydrophobicContact CG1-CG 4.39Å; V422-M426 HydrophobicContact CG1-SD 4.26Å; V422-M426 WeakPolarHBondContact O-CB 3.25Å; V422-M426 WeakPolarHBondContact O-CG 3.43Å; V422-M426 PolarHBondContact O-N 3.44Å; Y423-M426 PolarHBondContact O-N 3.28Å; M426-R430 WeakPolarHBondContact O-CA 3.5Å; M426-R430 PolarHBondContact O-N 3.17Å; M426-I433 HydrophobicContact CE-CB 3.56Å; M426-I433 HydrophobicContact CE-CG1 3.31Å; M426-I433 HydrophobicContact CE-CG2 4.19Å; M426-I433 HydrophobicContact CG-CG1 3.77Å; M426-I433 HydrophobicContact SD-CG1 4.37Å; M426-I502 HydrophobicContact CE-CG2 4.05Å; M426-I502 HydrophobicContact SD-CB 4.44Å; M426-I502 HydrophobicContact SD-CD1 4.07Å; M426-I502 HydrophobicContact SD-CG1 3.87Å; M426-I502 HydrophobicContact SD-CG2 3.77Å; M426-V510 HydrophobicContact CE-CG2 3.46Å; M426-V510 VanDerWaalsContact CE-CG2 3.46Å; M426-V510 HydrophobicContact SD-CG2 4.43Å
427	I	84.2	Confident	86	Confident	55 Å²	55	31.4 Å²	31.4	28%	0.282	13%	0.133	S	C	.	.	H	α-helix	trans	-72.7	-41.6	-173.8	-69.3	172.8	0	0	0	112.2	Y423 Y506	Y423-I427 HydrophobicContact CD1-CD1 4.05Å; Y423-I427 HydrophobicContact CD2-CD1 3.66Å; Y423-I427 HydrophobicContact CE1-CD1 3.58Å; Y423-I427 HydrophobicContact CE2-CD1 3.15Å; Y423-I427 HydrophobicContact CE2-CG1 4.4Å; Y423-I427 HydrophobicContact CG-CD1 4.08Å; Y423-I427 PolarHBondContact O-N 3.31Å; Y423-I427 WeakPolarHBondContact OH-CD1 3.48Å; I427-Y506 HydrophobicContact CG1-CE2 4.09Å
428	R	80.5	Confident	85.9	Confident	91 Å²	91	29.9 Å²	29.9	34%	0.343	13%	0.13	S	C	.	.	H	α-helix	trans	-79.8	-39.3	-175.2	-65.7	176.4	177.8	-144.6	-7.5	113	E254 A257 C424	E254-R428 PolarHBondContact O-NH1 2.88Å; E254-R428 IonicContact OE1-CZ 3.78Å; E254-R428 IonicContact OE1-NH1 3.35Å; E254-R428 PolarHBondContact OE1-NH1 2.95Å; E254-R428 IonicContact OE1-NH2 3.77Å; E254-R428 PolarHBondContact OE1-NH2 2.8Å; E254-R428 IonicContact OE2-NH2 3.52Å; E254-R428 PolarHBondContact OE2-NH2 3Å; A257-R428 HydrophobicContact CB-CB 4.36Å; C424-R428 VanDerWaalsContact O-CB 3.24Å; C424-R428 WeakPolarHBondContact O-CB 3.21Å; C424-R428 VanDerWaalsContact O-CG 3.31Å; C424-R428 WeakPolarHBondContact O-CG 3.41Å; C424-R428 PolarHBondContact O-N 2.63Å; C424-R428 VanDerWaalsContact O-N 3.11Å
429	N	78.7	Confident	85.5	Confident	34 Å²	34	29.7 Å²	29.7	18%	0.182	13%	0.129	C	C	.	.	H	α-helix	trans	-109.9	-9.3	-170.9	-59.3	-19.4	0	0	0	113.3	A257 E260 R261 M407 S425 C431	A257-N429 PolarHBondContact O-ND2 3.28Å; A257-N429 PolarHBondContact O-OD1 2.73Å; E260-N429 PolarHBondContact OE2-ND2 3.26Å; R261-N429 WeakPolarHBondContact CB-OD1 3.44Å; M407-N429 HydrophobicContact SD-CB 4.48Å; S425-N429 WeakPolarHBondContact O-CB 3.33Å; S425-N429 PolarHBondContact O-N 2.78Å; S425-N429 VanDerWaalsContact O-N 3.13Å; N429-C431 HydrophobicContact CB-CB 4.39Å; N429-C431 PolarHBondContact O-N 2.89Å
430	R	79.8	Confident	85.2	Confident	135 Å²	135	31.5 Å²	31.5	51%	0.509	14%	0.142	S	C	.	.			trans	51.3	39.9	-168	-63.5	-169.4	171.4	-150.8	-5.7	111.8	M426 P432 L509	M426-R430 WeakPolarHBondContact O-CA 3.5Å; M426-R430 PolarHBondContact O-N 3.17Å; R430-P432 WeakPolarHBondContact O-CD 3.39Å; R430-L509 HydrophobicContact CB-CD1 4.32Å
431	C	83	Confident	85.1	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.014	12%	0.121	C	C	.	.			trans	-72.4	123.3	-178.9	-176.7	0	0	0	0	110.3	M407 G409 N429 I433	M407-C431 HydrophobicContact SD-CB 4.1Å; G409-C431 PolarHBondContact N-SG 2.79Å; G409-C431 VanDerWaalsContact N-SG 3.4Å; N429-C431 HydrophobicContact CB-CB 4.39Å; N429-C431 PolarHBondContact O-N 2.89Å; C431-I433 HydrophobicContact CB-CD1 4.46Å
432	P	87.7	Confident	85.1	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.032	12%	0.116	C	C	.	.			trans	-66.4	139.3	169.5	26.7	-33.5	0	0	0	111	M407 C408 G409 R430 L509 L529	M407-P432 VanDerWaalsContact O-CD 3.23Å; M407-P432 WeakPolarHBondContact O-CD 3.48Å; M407-P432 WeakPolarHBondContact O-CG 3.41Å; C408-P432 WeakPolarHBondContact CA-O 3.37Å; G409-P432 PolarHBondContact N-O 3.26Å; R430-P432 WeakPolarHBondContact O-CD 3.39Å; P432-L509 CarbonylContact C-O 3.58Å; P432-L509 VanDerWaalsContact CA-O 3.28Å; P432-L509 WeakPolarHBondContact CA-O 3.05Å; P432-L529 HydrophobicContact CG-CD2 4.1Å
433	I	89.1	Confident	85.1	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.5	-174.1	-57.4	-60.7	0	0	0	110.6	F107 G409 V411 V422 M426 C431 V435 L509 V510 S511	F107-I433 HydrophobicContact CE2-CD1 3.99Å; G409-I433 CarbonylContact O-C 3.56Å; G409-I433 WeakPolarHBondContact O-CA 3.24Å; V411-I433 HydrophobicContact CG2-CG2 3.44Å; V411-I433 VanDerWaalsContact CG2-CG2 3.44Å; V422-I433 HydrophobicContact CG1-CG1 4.18Å; V422-I433 HydrophobicContact CG1-CG2 4.32Å; M426-I433 HydrophobicContact CE-CB 3.56Å; M426-I433 HydrophobicContact CE-CG1 3.31Å; M426-I433 HydrophobicContact CE-CG2 4.19Å; M426-I433 HydrophobicContact CG-CG1 3.77Å; M426-I433 HydrophobicContact SD-CG1 4.37Å; C431-I433 HydrophobicContact CB-CD1 4.46Å; I433-V435 HydrophobicContact CG2-CG2 4.07Å; I433-L509 PolarHBondContact N-O 2.8Å; I433-V510 WeakPolarHBondContact O-CA 3.09Å; I433-S511 PolarHBondContact O-N 2.73Å; I433-S511 PolarHBondContact O-OG 2.66Å
434	V	90.3	Very high	85	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.4	169.9	-176.4	0	0	0	0	108.4	G409 L410 V411 S511 F513 L521 V525 S528	G409-V434 PolarHBondContact O-N 2.92Å; L410-V434 WeakPolarHBondContact CA-O 3.09Å; L410-V434 HydrophobicContact CD1-CB 3.99Å; L410-V434 HydrophobicContact CD1-CG1 4.02Å; V411-V434 PolarHBondContact N-O 3.37Å; V434-S511 CarbonylContact C-O 3.59Å; V434-S511 WeakPolarHBondContact CA-O 3.41Å; V434-S511 WeakPolarHBondContact CG2-OG 3.07Å; V434-F513 HydrophobicContact CG1-CB 3.88Å; V434-L521 HydrophobicContact CG1-CD1 4.43Å; V434-V525 HydrophobicContact CG2-CG2 4.16Å; V434-S528 WeakPolarHBondContact CG2-OG 3.42Å
435	V	90.5	Very high	85.1	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.4	-178.8	-179.6	0	0	0	0	108.7	I433 K437 A443 L446 A447 V510 S511 F513	I433-V435 HydrophobicContact CG2-CG2 4.07Å; V435-K437 PolarHBondContact O-N 3.47Å; V435-A443 HydrophobicContact CG1-CB 4.25Å; V435-A443 WeakPolarHBondContact CG1-O 3.45Å; V435-L446 HydrophobicContact CG1-CB 3.93Å; V435-L446 HydrophobicContact CG2-CB 4.07Å; V435-L446 HydrophobicContact CG2-CD1 4.16Å; V435-A447 HydrophobicContact CG1-CB 4.1Å; V435-V510 HydrophobicContact CG2-CG1 3.85Å; V435-S511 PolarHBondContact N-O 2.82Å; V435-F513 PolarHBondContact O-N 3.07Å
436	T	88	Confident	85.3	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	98.1	180	61.4	0	0	0	0	111.2	L410 V411 V412 T439 F513 M515 L521	L410-T436 HydrophobicContact CD1-CG2 3.65Å; V411-T436 PolarHBondContact O-N 3.02Å; V411-T436 PolarHBondContact O-OG1 3.41Å; V412-T436 WeakPolarHBondContact CA-OG1 3.4Å; V412-T436 HydrophobicContact CG2-CG2 3.95Å; T436-T439 PolarHBondContact O-OG1 3.32Å; T436-T439 WeakPolarHBondContact OG1-CG2 3.32Å; T436-T439 PolarHBondContact OG1-OG1 2.74Å; T436-T439 VanDerWaalsContact OG1-OG1 3.11Å; T436-F513 CarbonylContact C-O 3.46Å; T436-F513 WeakPolarHBondContact CA-O 3.41Å; T436-F513 HydrophobicContact CG2-CD1 4.03Å; T436-M515 HydrophobicContact CG2-CG 4.34Å; T436-M515 HydrophobicContact CG2-SD 4.3Å; T436-L521 HydrophobicContact CG2-CD1 4.47Å
437	K	87	Confident	85.4	Confident	67 Å²	67	22.1 Å²	22.1	29%	0.291	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	140.3	175.6	-180	179.9	167	-133.8	0	110.3	V435 D444 A447 V512 F513 D514 M515	V435-K437 PolarHBondContact O-N 3.47Å; K437-D444 WeakPolarHBondContact CA-OD1 3.23Å; K437-A447 HydrophobicContact CB-CB 4.08Å; K437-A447 HydrophobicContact CG-CB 4.26Å; K437-V512 HydrophobicContact CB-CG1 3.86Å; K437-V512 HydrophobicContact CD-CG1 4.32Å; K437-F513 PolarHBondContact N-O 3.24Å; K437-D514 IonicContact NZ-OD2 3.24Å; K437-D514 PolarHBondContact NZ-OD2 3.46Å; K437-M515 PolarHBondContact O-N 2.8Å
438	G	79.9	Confident	85.6	Confident	14 Å²	14	22.9 Å²	22.9	14%	0.144	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	2.4	-176.9	0	0	0	0	0	113.8	K113 D444	K113-G438 WeakPolarHBondContact CD-O 3.25Å; K113-G438 PolarHBondContact NZ-O 3.27Å; G438-D444 PolarHBondContact N-OD1 3.29Å
439	T	79.8	Confident	85.8	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-101	4.6	-175.6	62.4	0	0	0	0	114.9	V412 G413 T436 A443 M515	V412-T439 HydrophobicContact CG1-CG2 3.98Å; G413-T439 WeakPolarHBondContact CA-O 3.13Å; G413-T439 PolarHBondContact N-OG1 2.86Å; T436-T439 PolarHBondContact O-OG1 3.32Å; T436-T439 WeakPolarHBondContact OG1-CG2 3.32Å; T436-T439 PolarHBondContact OG1-OG1 2.74Å; T436-T439 VanDerWaalsContact OG1-OG1 3.11Å; T439-A443 VanDerWaalsContact OG1-CB 3.27Å; T439-A443 WeakPolarHBondContact OG1-CB 3.45Å; T439-M515 HydrophobicContact CG2-CG 4.44Å; T439-M515 HydrophobicContact CG2-SD 3.42Å; T439-M515 WeakPolarHBondContact CG2-SD 3.23Å
440	S	81.2	Confident	86.1	Confident	40 Å²	40	17.8 Å²	17.8	28%	0.28	9%	0.087	S	C	.	.			trans	59.8	174.4	-177	39.1	0	0	0	0	114.9	K113 G413 D444	K113-S440 WeakPolarHBondContact CE-OG 3.48Å; K113-S440 VanDerWaalsContact NZ-CB 3.28Å; K113-S440 VanDerWaalsContact NZ-N 3.14Å; K113-S440 PolarHBondContact NZ-OG 3.34Å; G413-S440 CarbonylContact C-O 3.21Å; G413-S440 VanDerWaalsContact CA-O 3.25Å; G413-S440 WeakPolarHBondContact CA-O 3.42Å; S440-D444 WeakPolarHBondContact CA-OD2 3.46Å; S440-D444 PolarHBondContact N-OD2 3.35Å
441	G	84.4	Confident	86.4	Confident	2 Å²	2	14.4 Å²	14.4	2%	0.021	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	-143.1	176.5	0	0	0	0	0	113.6	G414 A443 D444 V445	G414-G441 CarbonylContact O-C 3.58Å; G414-G441 VanDerWaalsContact O-CA 3.29Å; G414-G441 WeakPolarHBondContact O-CA 3.45Å; G441-A443 VanDerWaalsContact C-N 3.28Å; G441-A443 PolarHBondContact O-N 2.98Å; G441-D444 PolarHBondContact O-N 3.44Å; G441-V445 WeakPolarHBondContact O-CG2 3.39Å; G441-V445 PolarHBondContact O-N 3.4Å; G441-V445 VanDerWaalsContact O-N 3.07Å
442	A	87	Confident	86.3	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59.4	-32.3	-175.3	0	0	0	0	0	114.2	G414 T418 L419 L446	G414-A442 PolarHBondContact O-N 3.1Å; T418-A442 HydrophobicContact CG2-CB 4.45Å; L419-A442 HydrophobicContact CB-CB 4.41Å; A442-L446 WeakPolarHBondContact O-CG 3.17Å; A442-L446 PolarHBondContact O-N 2.51Å; A442-L446 VanDerWaalsContact O-N 3.07Å
443	A	88.4	Confident	85.9	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.8	-47.2	176	0	0	0	0	0	112.1	V411 G413 V435 T439 G441 L446 A447	V411-A443 HydrophobicContact CG1-CB 4.06Å; G413-A443 WeakPolarHBondContact O-CB 3.24Å; G413-A443 PolarHBondContact O-N 3.42Å; V435-A443 HydrophobicContact CG1-CB 4.25Å; V435-A443 WeakPolarHBondContact CG1-O 3.45Å; T439-A443 VanDerWaalsContact OG1-CB 3.27Å; T439-A443 WeakPolarHBondContact OG1-CB 3.45Å; G441-A443 VanDerWaalsContact C-N 3.28Å; G441-A443 PolarHBondContact O-N 2.98Å; A443-L446 PolarHBondContact O-N 2.91Å; A443-A447 WeakPolarHBondContact O-CB 3.41Å; A443-A447 PolarHBondContact O-N 2.95Å
444	D	88.5	Confident	85.4	Confident	8 Å²	8	19.2 Å²	19.2	4%	0.043	11%	0.107	C	C	.	.	H	α-helix	trans	-72.4	-34.4	179.3	-76.6	-15.5	0	0	0	111	K437 G438 S440 G441 L446 A447 F448 F481	K437-D444 WeakPolarHBondContact CA-OD1 3.23Å; G438-D444 PolarHBondContact N-OD1 3.29Å; S440-D444 WeakPolarHBondContact CA-OD2 3.46Å; S440-D444 PolarHBondContact N-OD2 3.35Å; G441-D444 PolarHBondContact O-N 3.44Å; D444-L446 VanDerWaalsContact C-N 3.33Å; D444-L446 PolarHBondContact O-N 2.64Å; D444-A447 PolarHBondContact O-N 3.06Å; D444-F448 HydrophobicContact CB-CD2 3.96Å; D444-F448 HydrophobicContact CB-CE2 4.04Å; D444-F448 WeakPolarHBondContact O-CB 3.21Å; D444-F448 WeakPolarHBondContact O-CD2 3.14Å; D444-F448 PolarHBondContact O-N 3.22Å; D444-F481 HydrophobicContact CB-CD1 3.87Å; D444-F481 HydrophobicContact CB-CD2 4.37Å; D444-F481 HydrophobicContact CB-CE1 3.88Å; D444-F481 HydrophobicContact CB-CE2 4.4Å; D444-F481 HydrophobicContact CB-CG 4.14Å; D444-F481 HydrophobicContact CB-CZ 4.17Å
445	V	88.8	Confident	84.7	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-55.4	-46.7	170.8	171.4	0	0	0	0	111.8	L419 G441 G449 I478 F481 L482 L499	L419-V445 HydrophobicContact CD1-CG1 4.17Å; G441-V445 WeakPolarHBondContact O-CG2 3.39Å; G441-V445 PolarHBondContact O-N 3.4Å; G441-V445 VanDerWaalsContact O-N 3.07Å; V445-G449 WeakPolarHBondContact O-CA 3.35Å; V445-G449 PolarHBondContact O-N 3.43Å; V445-I478 HydrophobicContact CG1-CD1 4.46Å; V445-I478 HydrophobicContact CG1-CG1 3.6Å; V445-I478 HydrophobicContact CG2-CG1 4.44Å; V445-F481 HydrophobicContact CG2-CB 3.72Å; V445-F481 HydrophobicContact CG2-CD2 4.45Å; V445-F481 HydrophobicContact CG2-CG 4.48Å; V445-L482 HydrophobicContact CG2-CD1 4.04Å; V445-L482 HydrophobicContact CG2-CG 4.05Å; V445-L499 HydrophobicContact CG1-CD2 3.87Å
446	L	88.7	Confident	83.7	Confident	5 Å²	5	27 Å²	27	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-66.3	-43	176.9	-76.4	165.4	0	0	0	112.1	V411 V422 V435 A442 A443 D444 L450 L499 I502	V411-L446 HydrophobicContact CG1-CD1 4.47Å; V422-L446 HydrophobicContact CG1-CD1 4.32Å; V435-L446 HydrophobicContact CG1-CB 3.93Å; V435-L446 HydrophobicContact CG2-CB 4.07Å; V435-L446 HydrophobicContact CG2-CD1 4.16Å; A442-L446 WeakPolarHBondContact O-CG 3.17Å; A442-L446 PolarHBondContact O-N 2.51Å; A442-L446 VanDerWaalsContact O-N 3.07Å; A443-L446 PolarHBondContact O-N 2.91Å; D444-L446 VanDerWaalsContact C-N 3.33Å; D444-L446 PolarHBondContact O-N 2.64Å; L446-L450 WeakPolarHBondContact O-CB 3.48Å; L446-L450 PolarHBondContact O-N 3.1Å; L446-L499 HydrophobicContact CD2-CD1 3.55Å; L446-L499 HydrophobicContact CG-CD1 4.46Å; L446-I502 HydrophobicContact CD2-CD1 4.44Å
447	A	88.2	Confident	82.7	Confident	5 Å²	5	31.2 Å²	31.2	4%	0.041	18%	0.177	C	C	.	.	H	α-helix	trans	-67.4	-48.6	-177.8	0	0	0	0	0	112.5	V435 K437 A443 D444 L450 D451 V512	V435-A447 HydrophobicContact CG1-CB 4.1Å; K437-A447 HydrophobicContact CB-CB 4.08Å; K437-A447 HydrophobicContact CG-CB 4.26Å; A443-A447 WeakPolarHBondContact O-CB 3.41Å; A443-A447 PolarHBondContact O-N 2.95Å; D444-A447 PolarHBondContact O-N 3.06Å; A447-L450 PolarHBondContact O-N 3.03Å; A447-D451 PolarHBondContact O-N 3.14Å; A447-V512 HydrophobicContact CB-CG1 4Å; A447-V512 HydrophobicContact CB-CG2 4.46Å
448	F	88.1	Confident	81.5	Confident	71 Å²	71	31.9 Å²	31.9	31%	0.311	19%	0.191	S	C	.	.	H	α-helix	trans	-71.9	-34	178.2	-74.1	-72.1	0	0	0	112.1	D444 D451 A452 I477 F481	D444-F448 HydrophobicContact CB-CD2 3.96Å; D444-F448 HydrophobicContact CB-CE2 4.04Å; D444-F448 WeakPolarHBondContact O-CB 3.21Å; D444-F448 WeakPolarHBondContact O-CD2 3.14Å; D444-F448 PolarHBondContact O-N 3.22Å; F448-D451 PolarHBondContact O-N 2.87Å; F448-A452 WeakPolarHBondContact O-CB 3.32Å; F448-A452 PolarHBondContact O-N 3.49Å; F448-I477 HydrophobicContact CB-CD1 4.19Å; F448-I477 HydrophobicContact CB-CG2 3.91Å; F448-F481 HydrophobicContact CD2-CD2 4.38Å; F448-F481 HydrophobicContact CD2-CE1 4.48Å; F448-F481 AromaticContact CD2-CE2 3.41Å; F448-F481 HydrophobicContact CD2-CE2 3.41Å; F448-F481 VanDerWaalsContact CD2-CE2 3.41Å; F448-F481 AromaticContact CD2-CZ 3.48Å; F448-F481 HydrophobicContact CD2-CZ 3.48Å; F448-F481 VanDerWaalsContact CD2-CZ 3.48Å; F448-F481 HydrophobicContact CE2-CE1 4.18Å; F448-F481 AromaticContact CE2-CE2 3.82Å; F448-F481 HydrophobicContact CE2-CE2 3.82Å; F448-F481 AromaticContact CE2-CZ 3.35Å; F448-F481 HydrophobicContact CE2-CZ 3.35Å; F448-F481 HydrophobicContact CG-CE2 4.12Å; F448-F481 HydrophobicContact CG-CZ 4.45Å; F448-F481 HydrophobicContact CZ-CZ 4.21Å
449	G	85.5	Confident	80.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-42.9	173.1	0	0	0	0	0	112.6	V445 A452 A453	V445-G449 WeakPolarHBondContact O-CA 3.35Å; V445-G449 PolarHBondContact O-N 3.43Å; G449-A452 PolarHBondContact O-N 2.72Å; G449-A453 PolarHBondContact O-N 3.14Å; G449-A453 VanDerWaalsContact O-N 3.15Å
450	L	85.2	Confident	79	Confident	19 Å²	19	47 Å²	47	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-41	176.3	-166.1	73.1	0	0	0	112.2	L446 A447 A453 N454 T507 V510 V512	L446-L450 WeakPolarHBondContact O-CB 3.48Å; L446-L450 PolarHBondContact O-N 3.1Å; A447-L450 PolarHBondContact O-N 3.03Å; L450-A453 PolarHBondContact O-N 3.4Å; L450-N454 WeakPolarHBondContact O-CB 3.43Å; L450-N454 PolarHBondContact O-N 3.23Å; L450-N454 PolarHBondContact O-ND2 3.45Å; L450-T507 HydrophobicContact CD1-CG2 4.42Å; L450-V510 HydrophobicContact CD2-CG1 4.28Å; L450-V512 HydrophobicContact CD2-CG2 3.87Å
451	D	84.7	Confident	77.3	Confident	64 Å²	64	51.3 Å²	51.3	34%	0.342	28%	0.282	S	S	.	.	H	α-helix	trans	-64.7	-39.2	176	-175.2	41	0	0	0	111.9	A447 F448 A453 N454 K455	A447-D451 PolarHBondContact O-N 3.14Å; F448-D451 PolarHBondContact O-N 2.87Å; D451-A453 PolarHBondContact O-N 3.13Å; D451-N454 PolarHBondContact O-N 3.01Å; D451-K455 WeakPolarHBondContact O-CB 3.48Å; D451-K455 WeakPolarHBondContact O-CG 3.42Å; D451-K455 PolarHBondContact O-N 3.5Å; D451-K455 VanDerWaalsContact OD1-CE 3.29Å; D451-K455 WeakPolarHBondContact OD1-CE 3.39Å; D451-K455 IonicContact OD1-NZ 2.66Å; D451-K455 VanDerWaalsContact OD2-CE 3.26Å; D451-K455 WeakPolarHBondContact OD2-CE 3.43Å; D451-K455 IonicContact OD2-NZ 2.8Å; D451-K455 PolarHBondContact OD2-NZ 2.73Å
452	A	82.3	Confident	75.3	Confident	5 Å²	5	56.6 Å²	56.6	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-61.9	-42.7	174.6	0	0	0	0	0	112.2	F448 G449 M456 I477	F448-A452 WeakPolarHBondContact O-CB 3.32Å; F448-A452 PolarHBondContact O-N 3.49Å; G449-A452 PolarHBondContact O-N 2.72Å; A452-M456 WeakPolarHBondContact O-CG 3.45Å; A452-M456 PolarHBondContact O-N 2.97Å; A452-M456 VanDerWaalsContact O-N 3.13Å; A452-I477 HydrophobicContact CB-CD1 4.22Å
453	A	79.2	Confident	73.4	Confident	17 Å²	17	62.4 Å²	62.4	14%	0.14	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-42.8	176.5	0	0	0	0	0	112.3	G449 L450 D451 M456 A457 L470 I503	G449-A453 PolarHBondContact O-N 3.14Å; G449-A453 VanDerWaalsContact O-N 3.15Å; L450-A453 PolarHBondContact O-N 3.4Å; D451-A453 PolarHBondContact O-N 3.13Å; A453-M456 PolarHBondContact O-N 3.45Å; A453-A457 PolarHBondContact O-N 3.13Å; A453-A457 VanDerWaalsContact O-N 3.08Å; A453-L470 HydrophobicContact CB-CD1 4.15Å; A453-I503 HydrophobicContact CB-CG2 3.57Å
454	N	77.9	Confident	71.4	Confident	85 Å²	85	70.6 Å²	70.6	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-65.2	-41.1	177.3	-75.5	-28	0	0	0	112.4	L450 D451 A457 S458	L450-N454 WeakPolarHBondContact O-CB 3.43Å; L450-N454 PolarHBondContact O-N 3.23Å; L450-N454 PolarHBondContact O-ND2 3.45Å; D451-N454 PolarHBondContact O-N 3.01Å; N454-A457 PolarHBondContact O-N 3.13Å; N454-S458 PolarHBondContact O-N 2.91Å; N454-S458 VanDerWaalsContact O-N 3.11Å; N454-S458 PolarHBondContact O-OG 3.16Å
455	K	76.4	Confident	69.5	Low	91 Å²	91	76.9 Å²	76.9	40%	0.396	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-44.6	175.9	-77.9	170.8	176.6	164.9	0	111.5	D451 A457 S458 E459	D451-K455 WeakPolarHBondContact O-CB 3.48Å; D451-K455 WeakPolarHBondContact O-CG 3.42Å; D451-K455 PolarHBondContact O-N 3.5Å; D451-K455 VanDerWaalsContact OD1-CE 3.29Å; D451-K455 WeakPolarHBondContact OD1-CE 3.39Å; D451-K455 IonicContact OD1-NZ 2.66Å; D451-K455 VanDerWaalsContact OD2-CE 3.26Å; D451-K455 WeakPolarHBondContact OD2-CE 3.43Å; D451-K455 IonicContact OD2-NZ 2.8Å; D451-K455 PolarHBondContact OD2-NZ 2.73Å; K455-A457 VanDerWaalsContact C-N 3.28Å; K455-A457 PolarHBondContact O-N 3.26Å; K455-S458 PolarHBondContact O-N 3.03Å; K455-S458 VanDerWaalsContact O-N 3.1Å; K455-S458 PolarHBondContact O-OG 2.93Å; K455-E459 PolarHBondContact O-N 3.39Å; K455-E459 VanDerWaalsContact O-N 3.13Å
456	M	69.1	Low	67.9	Low	73 Å²	73	84.6 Å²	84.6	36%	0.36	46%	0.457	S	S	.	.	H	α-helix	trans	-61.9	-32.5	174.9	-75.3	-175.3	-179	0	0	113.1	A452 A453 V468 L470 R473	A452-M456 WeakPolarHBondContact O-CG 3.45Å; A452-M456 PolarHBondContact O-N 2.97Å; A452-M456 VanDerWaalsContact O-N 3.13Å; A453-M456 PolarHBondContact O-N 3.45Å; M456-V468 WeakPolarHBondContact CE-O 3.42Å; M456-L470 HydrophobicContact SD-CB 4.1Å; M456-L470 HydrophobicContact SD-CD1 3.9Å; M456-R473 HydrophobicContact CE-CB 4.46Å
457	A	65.8	Low	66.3	Low	89 Å²	89	93 Å²	93	74%	0.736	50%	0.496	S	S	*	.	H	α-helix	trans	-73.9	-25.2	175	0	0	0	0	0	113.5	A453 N454 K455	A453-A457 PolarHBondContact O-N 3.13Å; A453-A457 VanDerWaalsContact O-N 3.08Å; N454-A457 PolarHBondContact O-N 3.13Å; K455-A457 VanDerWaalsContact C-N 3.28Å; K455-A457 PolarHBondContact O-N 3.26Å
458	S	62.4	Low	65.2	Low	82 Å²	82	96.8 Å²	96.8	57%	0.573	52%	0.518	S	S	*	.	H	α-helix	trans	-95.9	-24.8	-173.7	68.9	0	0	0	0	115.6	N454 K455 E460	N454-S458 PolarHBondContact O-N 2.91Å; N454-S458 VanDerWaalsContact O-N 3.11Å; N454-S458 PolarHBondContact O-OG 3.16Å; K455-S458 PolarHBondContact O-N 3.03Å; K455-S458 VanDerWaalsContact O-N 3.1Å; K455-S458 PolarHBondContact O-OG 2.93Å; S458-E460 VanDerWaalsContact C-N 3.33Å; S458-E460 PolarHBondContact O-N 3.48Å
459	E	57.1	Low	64.5	Low	153 Å²	153	97.5 Å²	97.5	72%	0.715	53%	0.53	S	S	*	.			trans	-80.7	73.7	-174.3	-77.3	-172.5	155.2	0	0	113.2	K455 V461	K455-E459 PolarHBondContact O-N 3.39Å; K455-E459 VanDerWaalsContact O-N 3.13Å; E459-V461 VanDerWaalsContact C-N 3.28Å; E459-V461 PolarHBondContact O-N 3.12Å
460	E	49.6	Very low	64	Low	177 Å²	177	99.4 Å²	99.4	83%	0.827	54%	0.54	S	S	*	.			trans	-61.3	74.8	-178.2	-166	177.6	-141.4	0	0	114.2	S458 V462	S458-E460 VanDerWaalsContact C-N 3.33Å; S458-E460 PolarHBondContact O-N 3.48Å; E460-V462 VanDerWaalsContact C-N 3.33Å; E460-V462 PolarHBondContact O-N 3.35Å; E460-V462 VanDerWaalsContact O-N 3.12Å
461	V	45.4	Very low	63.7	Low	131 Å²	131	103.6 Å²	103.6	79%	0.794	56%	0.559	S	S	*	*	S	Bend	trans	56.5	32.6	159	-148.7	0	0	0	0	115.6	E459	E459-V461 VanDerWaalsContact C-N 3.28Å; E459-V461 PolarHBondContact O-N 3.12Å
462	V	43.1	Very low	63.4	Low	113 Å²	113	102.6 Å²	102.6	69%	0.685	56%	0.56	S	S	*	*			trans	-84.9	114.7	165.9	-174	0	0	0	0	109.8	E460 K465	E460-V462 VanDerWaalsContact C-N 3.33Å; E460-V462 PolarHBondContact O-N 3.35Å; E460-V462 VanDerWaalsContact O-N 3.12Å; V462-K465 PolarHBondContact O-NZ 3.39Å
463	D	46.7	Very low	63.3	Low	123 Å²	123	107.3 Å²	107.3	66%	0.658	58%	0.576	S	S	*	*	S	Bend	trans	72.3	124	171.4	-83.3	-26.7	0	0	0	118.9	K465	D463-K465 WeakPolarHBondContact O-CE 3.36Å; D463-K465 WeakPolarHBondContact O-CG 3.36Å; D463-K465 PolarHBondContact O-N 2.93Å; D463-K465 PolarHBondContact O-NZ 3.17Å
464	D	46.6	Very low	63.5	Low	172 Å²	172	106.5 Å²	106.5	92%	0.92	57%	0.57	S	S	*	*			trans	-52.7	106.1	175.3	-63.8	-106.5	0	0	0	110.9
465	K	49.9	Very low	63.8	Low	140 Å²	140	106.6 Å²	106.6	61%	0.609	57%	0.567	S	S	*	*			trans	-141.7	148.5	-176.8	-73.8	178.5	-100.5	65.4	0	109.1	V462 D463 Q467	V462-K465 PolarHBondContact O-NZ 3.39Å; D463-K465 WeakPolarHBondContact O-CE 3.36Å; D463-K465 WeakPolarHBondContact O-CG 3.36Å; D463-K465 PolarHBondContact O-N 2.93Å; D463-K465 PolarHBondContact O-NZ 3.17Å; K465-Q467 PolarHBondContact O-N 3.23Å
466	D	53.9	Low	64	Low	161 Å²	161	105.5 Å²	105.5	86%	0.861	57%	0.571	S	S	*	*			trans	-58.2	106.1	170.3	-65.1	-46.9	0	0	0	109.9	V468	D466-V468 PolarHBondContact O-N 3.49Å
467	Q	55.6	Low	64.7	Low	183 Å²	183	102.7 Å²	102.7	86%	0.855	56%	0.557	S	S	*	*			trans	-74.6	107.8	174.9	-71.2	-177.3	-0.2	0	0	109.1	K465	K465-Q467 PolarHBondContact O-N 3.23Å
468	V	65.3	Low	65.6	Low	84 Å²	84	98.5 Å²	98.5	51%	0.509	52%	0.522	S	S	.	.			trans	-71	126.6	172.7	-179.6	0	0	0	0	109	M456 D466 A472	M456-V468 WeakPolarHBondContact CE-O 3.42Å; D466-V468 PolarHBondContact O-N 3.49Å; V468-A472 HydrophobicContact CG1-CB 4.22Å
469	P	72.1	Confident	66.6	Low	85 Å²	85	100.3 Å²	100.3	55%	0.552	52%	0.522	S	S	*	.			trans	-63.4	148.7	179.3	22.5	-29.8	0	0	0	111.9	E471 A472 R473	P469-E471 VanDerWaalsContact C-N 3.3Å; P469-E471 PolarHBondContact O-N 3.11Å; P469-A472 HydrophobicContact CG-CB 4.05Å; P469-A472 PolarHBondContact O-N 3Å; P469-R473 PolarHBondContact O-N 2.8Å
470	L	76	Confident	67.8	Low	41 Å²	41	99.1 Å²	99.1	22%	0.215	52%	0.516	C	S	.	.	H	α-helix	trans	-55.9	-43.7	-176.3	-177.5	66.8	0	0	0	111.8	A453 M456 A472 R473 L474	A453-L470 HydrophobicContact CB-CD1 4.15Å; M456-L470 HydrophobicContact SD-CB 4.1Å; M456-L470 HydrophobicContact SD-CD1 3.9Å; L470-A472 PolarHBondContact O-N 3.06Å; L470-R473 WeakPolarHBondContact O-CB 3.46Å; L470-R473 PolarHBondContact O-N 3.46Å; L470-R473 VanDerWaalsContact O-N 3.12Å; L470-L474 HydrophobicContact CD1-CG 4.42Å; L470-L474 HydrophobicContact CG-CD1 4.07Å; L470-L474 HydrophobicContact CG-CG 4.29Å; L470-L474 WeakPolarHBondContact O-CG 3.32Å; L470-L474 PolarHBondContact O-N 2.79Å
471	E	78.4	Confident	69.2	Low	106 Å²	106	92.5 Å²	92.5	50%	0.495	49%	0.485	S	S	.	.	H	α-helix	trans	-57.1	-47.9	-179.6	-65.3	172.6	-179.3	0	0	112.4	P469 R473 L474 E475	P469-E471 VanDerWaalsContact C-N 3.3Å; P469-E471 PolarHBondContact O-N 3.11Å; E471-R473 VanDerWaalsContact C-N 3.26Å; E471-R473 PolarHBondContact O-N 3.1Å; E471-L474 PolarHBondContact O-N 3.47Å; E471-L474 VanDerWaalsContact O-N 3.15Å; E471-E475 PolarHBondContact O-N 3.27Å
472	A	79.7	Confident	70.9	Confident	43 Å²	43	86.3 Å²	86.3	36%	0.355	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-32.1	178.6	0	0	0	0	0	112.4	V468 P469 L470 S476	V468-A472 HydrophobicContact CG1-CB 4.22Å; P469-A472 HydrophobicContact CG-CB 4.05Å; P469-A472 PolarHBondContact O-N 3Å; L470-A472 PolarHBondContact O-N 3.06Å; A472-S476 PolarHBondContact O-N 3.48Å
473	R	79.9	Confident	72.3	Confident	105 Å²	105	82.1 Å²	82.1	40%	0.396	43%	0.427	S	S	.	.	H	α-helix	trans	-74	-35.5	176.1	-162.1	166.4	-176.6	166.9	-0.7	111.7	M456 P469 L470 E471 I477	M456-R473 HydrophobicContact CE-CB 4.46Å; P469-R473 PolarHBondContact O-N 2.8Å; L470-R473 WeakPolarHBondContact O-CB 3.46Å; L470-R473 PolarHBondContact O-N 3.46Å; L470-R473 VanDerWaalsContact O-N 3.12Å; E471-R473 VanDerWaalsContact C-N 3.26Å; E471-R473 PolarHBondContact O-N 3.1Å; R473-I477 HydrophobicContact CG-CD1 4.47Å; R473-I477 WeakPolarHBondContact O-CD1 3.33Å; R473-I477 VanDerWaalsContact O-CG1 3.25Å; R473-I477 WeakPolarHBondContact O-CG1 3.39Å; R473-I477 PolarHBondContact O-N 3.36Å; R473-I477 VanDerWaalsContact O-N 3.16Å
474	L	83.1	Confident	73.4	Confident	0 Å²	0	83.2 Å²	83.2	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-69.1	-41.2	174.6	-66.4	177.4	0	0	0	111.7	L470 E471 S476 I477 I478 L499 C500 I503	L470-L474 HydrophobicContact CD1-CG 4.42Å; L470-L474 HydrophobicContact CG-CD1 4.07Å; L470-L474 HydrophobicContact CG-CG 4.29Å; L470-L474 WeakPolarHBondContact O-CG 3.32Å; L470-L474 PolarHBondContact O-N 2.79Å; E471-L474 PolarHBondContact O-N 3.47Å; E471-L474 VanDerWaalsContact O-N 3.15Å; L474-S476 VanDerWaalsContact C-N 3.34Å; L474-S476 PolarHBondContact O-N 3.12Å; L474-I477 PolarHBondContact O-N 3.19Å; L474-I478 WeakPolarHBondContact O-CG1 3.41Å; L474-I478 PolarHBondContact O-N 3.35Å; L474-L499 HydrophobicContact CB-CD2 4.35Å; L474-L499 HydrophobicContact CD1-CD2 4.29Å; L474-L499 HydrophobicContact CD1-CG 4.33Å; L474-L499 HydrophobicContact CD2-CD2 3.73Å; L474-L499 HydrophobicContact CD2-CG 4.32Å; L474-L499 HydrophobicContact CG-CD2 4.33Å; L474-C500 VanDerWaalsContact CD1-SG 3.56Å; L474-I503 HydrophobicContact CD1-CD1 4.23Å; L474-I503 HydrophobicContact CD2-CD1 4.09Å
475	E	83.1	Confident	74.3	Confident	87 Å²	87	78.8 Å²	78.8	41%	0.407	41%	0.409	S	S	.	.	H	α-helix	trans	-56.3	-48	172.6	-79.9	179.6	170.2	0	0	111.2	E471 I477 I478 E479 V496	E471-E475 PolarHBondContact O-N 3.27Å; E475-I477 VanDerWaalsContact C-N 3.33Å; E475-I477 PolarHBondContact O-N 2.85Å; E475-I478 PolarHBondContact O-N 3.09Å; E475-E479 WeakPolarHBondContact O-CG 3.46Å; E475-E479 PolarHBondContact O-N 3.45Å; E475-V496 HydrophobicContact CG-CG1 4.44Å; E475-V496 HydrophobicContact CG-CG2 3.54Å
476	S	82.3	Confident	75.1	Confident	67 Å²	67	74.4 Å²	74.4	47%	0.469	39%	0.39	S	S	.	.	H	α-helix	trans	-59.9	-39.2	176.7	178.5	0	0	0	0	113.2	A472 L474 E480	A472-S476 PolarHBondContact O-N 3.48Å; L474-S476 VanDerWaalsContact C-N 3.34Å; L474-S476 PolarHBondContact O-N 3.12Å; S476-E480 WeakPolarHBondContact O-CB 3.45Å; S476-E480 PolarHBondContact O-N 3.34Å; S476-E480 VanDerWaalsContact O-N 3.09Å
477	I	83.6	Confident	75.5	Confident	15 Å²	15	71.7 Å²	71.7	8%	0.077	38%	0.382	C	S	.	.	H	α-helix	trans	-69.8	-39.9	178.3	-68.9	164.2	0	0	0	110.4	F448 A452 R473 L474 E475 E480 F481	F448-I477 HydrophobicContact CB-CD1 4.19Å; F448-I477 HydrophobicContact CB-CG2 3.91Å; A452-I477 HydrophobicContact CB-CD1 4.22Å; R473-I477 HydrophobicContact CG-CD1 4.47Å; R473-I477 WeakPolarHBondContact O-CD1 3.33Å; R473-I477 VanDerWaalsContact O-CG1 3.25Å; R473-I477 WeakPolarHBondContact O-CG1 3.39Å; R473-I477 PolarHBondContact O-N 3.36Å; R473-I477 VanDerWaalsContact O-N 3.16Å; L474-I477 PolarHBondContact O-N 3.19Å; E475-I477 VanDerWaalsContact C-N 3.33Å; E475-I477 PolarHBondContact O-N 2.85Å; I477-E480 PolarHBondContact O-N 3.39Å; I477-F481 HydrophobicContact CG2-CD2 3.9Å; I477-F481 HydrophobicContact CG2-CE2 4.16Å; I477-F481 VanDerWaalsContact O-CD2 3.31Å; I477-F481 WeakPolarHBondContact O-CD2 3.43Å; I477-F481 PolarHBondContact O-N 3.06Å; I477-F481 VanDerWaalsContact O-N 3.16Å
478	I	84.1	Confident	75.9	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-64.1	-45.9	177.3	-74.5	165.4	0	0	0	110.5	V445 L474 E475 E480 F481 L482 Y492 E495 V496 L499	V445-I478 HydrophobicContact CG1-CD1 4.46Å; V445-I478 HydrophobicContact CG1-CG1 3.6Å; V445-I478 HydrophobicContact CG2-CG1 4.44Å; L474-I478 WeakPolarHBondContact O-CG1 3.41Å; L474-I478 PolarHBondContact O-N 3.35Å; E475-I478 PolarHBondContact O-N 3.09Å; I478-E480 VanDerWaalsContact C-N 3.32Å; I478-E480 PolarHBondContact O-N 3.17Å; I478-F481 PolarHBondContact O-N 2.99Å; I478-L482 HydrophobicContact CG2-CB 4.46Å; I478-L482 HydrophobicContact CG2-CD1 4.05Å; I478-L482 WeakPolarHBondContact O-CA 3.46Å; I478-L482 VanDerWaalsContact O-CB 3.31Å; I478-L482 WeakPolarHBondContact O-CB 3.32Å; I478-L482 PolarHBondContact O-N 2.79Å; I478-Y492 HydrophobicContact CG2-CD1 3.46Å; I478-Y492 VanDerWaalsContact CG2-CD1 3.46Å; I478-Y492 HydrophobicContact CG2-CD2 3.85Å; I478-Y492 HydrophobicContact CG2-CE1 3.99Å; I478-Y492 HydrophobicContact CG2-CE2 4.36Å; I478-Y492 HydrophobicContact CG2-CG 3.37Å; I478-E495 HydrophobicContact CD1-CB 4.39Å; I478-V496 HydrophobicContact CD1-CB 4.44Å; I478-V496 HydrophobicContact CD1-CG2 3.58Å; I478-L499 HydrophobicContact CD1-CD2 4.29Å
479	E	82.7	Confident	75.9	Confident	120 Å²	120	69.8 Å²	69.8	56%	0.561	37%	0.37	S	S	*	.	H	α-helix	trans	-62.2	-39.6	177.2	-72.6	-176.9	170.2	0	0	112.1	E475 G483 Y492	E475-E479 WeakPolarHBondContact O-CG 3.46Å; E475-E479 PolarHBondContact O-N 3.45Å; E479-G483 VanDerWaalsContact O-CA 3.27Å; E479-G483 WeakPolarHBondContact O-CA 3.34Å; E479-G483 PolarHBondContact O-N 3.04Å; E479-Y492 HydrophobicContact CG-CD2 4.48Å
480	E	82	Confident	75.5	Confident	128 Å²	128	71.9 Å²	71.9	60%	0.598	38%	0.381	S	S	*	.	H	α-helix	trans	-63.4	-42.8	178.9	-175.2	178.9	-179	0	0	112.9	S476 I477 I478	S476-E480 WeakPolarHBondContact O-CB 3.45Å; S476-E480 PolarHBondContact O-N 3.34Å; S476-E480 VanDerWaalsContact O-N 3.09Å; I477-E480 PolarHBondContact O-N 3.39Å; I478-E480 VanDerWaalsContact C-N 3.32Å; I478-E480 PolarHBondContact O-N 3.17Å
481	F	80.7	Confident	75.4	Confident	39 Å²	39	73.9 Å²	73.9	17%	0.171	39%	0.392	C	S	.	.	H	α-helix	trans	-100.4	-26.7	-172.9	-70.6	-70.4	0	0	0	115.1	D444 V445 F448 I477 I478	D444-F481 HydrophobicContact CB-CD1 3.87Å; D444-F481 HydrophobicContact CB-CD2 4.37Å; D444-F481 HydrophobicContact CB-CE1 3.88Å; D444-F481 HydrophobicContact CB-CE2 4.4Å; D444-F481 HydrophobicContact CB-CG 4.14Å; D444-F481 HydrophobicContact CB-CZ 4.17Å; V445-F481 HydrophobicContact CG2-CB 3.72Å; V445-F481 HydrophobicContact CG2-CD2 4.45Å; V445-F481 HydrophobicContact CG2-CG 4.48Å; F448-F481 HydrophobicContact CD2-CD2 4.38Å; F448-F481 HydrophobicContact CD2-CE1 4.48Å; F448-F481 AromaticContact CD2-CE2 3.41Å; F448-F481 HydrophobicContact CD2-CE2 3.41Å; F448-F481 VanDerWaalsContact CD2-CE2 3.41Å; F448-F481 AromaticContact CD2-CZ 3.48Å; F448-F481 HydrophobicContact CD2-CZ 3.48Å; F448-F481 VanDerWaalsContact CD2-CZ 3.48Å; F448-F481 HydrophobicContact CE2-CE1 4.18Å; F448-F481 AromaticContact CE2-CE2 3.82Å; F448-F481 HydrophobicContact CE2-CE2 3.82Å; F448-F481 AromaticContact CE2-CZ 3.35Å; F448-F481 HydrophobicContact CE2-CZ 3.35Å; F448-F481 HydrophobicContact CG-CE2 4.12Å; F448-F481 HydrophobicContact CG-CZ 4.45Å; F448-F481 HydrophobicContact CZ-CZ 4.21Å; I477-F481 HydrophobicContact CG2-CD2 3.9Å; I477-F481 HydrophobicContact CG2-CE2 4.16Å; I477-F481 VanDerWaalsContact O-CD2 3.31Å; I477-F481 WeakPolarHBondContact O-CD2 3.43Å; I477-F481 PolarHBondContact O-N 3.06Å; I477-F481 VanDerWaalsContact O-N 3.16Å; I478-F481 PolarHBondContact O-N 2.99Å
482	L	80.1	Confident	75.3	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-104.6	-18.8	179.5	-70	168.8	0	0	0	113	V445 I478 D484 L485 H486 Y492	V445-L482 HydrophobicContact CG2-CD1 4.04Å; V445-L482 HydrophobicContact CG2-CG 4.05Å; I478-L482 HydrophobicContact CG2-CB 4.46Å; I478-L482 HydrophobicContact CG2-CD1 4.05Å; I478-L482 WeakPolarHBondContact O-CA 3.46Å; I478-L482 VanDerWaalsContact O-CB 3.31Å; I478-L482 WeakPolarHBondContact O-CB 3.32Å; I478-L482 PolarHBondContact O-N 2.79Å; L482-D484 VanDerWaalsContact C-N 3.25Å; L482-D484 PolarHBondContact O-N 3.03Å; L482-L485 PolarHBondContact O-N 2.81Å; L482-L485 VanDerWaalsContact O-N 3.09Å; L482-H486 PolarHBondContact O-N 3.08Å; L482-Y492 HydrophobicContact CB-CE1 4.14Å; L482-Y492 PolarHBondContact O-OH 2.82Å
483	G	72.3	Confident	75.4	Confident	25 Å²	25	70.5 Å²	70.5	26%	0.258	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-37.7	179.4	0	0	0	0	0	113.3	E479	E479-G483 VanDerWaalsContact O-CA 3.27Å; E479-G483 WeakPolarHBondContact O-CA 3.34Å; E479-G483 PolarHBondContact O-N 3.04Å
484	D	69.6	Low	75.4	Confident	147 Å²	147	70.1 Å²	70.1	79%	0.786	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-29.5	178.1	-70.7	-13.7	0	0	0	113.3	L482	L482-D484 VanDerWaalsContact C-N 3.25Å; L482-D484 PolarHBondContact O-N 3.03Å
485	L	65.1	Low	75.4	Confident	78 Å²	78	70.4 Å²	70.4	41%	0.408	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-25.2	-178.1	-83.5	109.9	0	0	0	113.5	L482	L482-L485 PolarHBondContact O-N 2.81Å; L482-L485 VanDerWaalsContact O-N 3.09Å
486	H	67.5	Low	75.5	Confident	49 Å²	49	66.6 Å²	66.6	23%	0.227	36%	0.362	C	S	.	.			trans	-135	74.7	-179.9	-70	-58.4	0	0	0	111.4	L482 D488 Y489	L482-H486 PolarHBondContact O-N 3.08Å; H486-D488 PolarHBondContact O-N 2.84Å; H486-D488 VanDerWaalsContact O-N 3.15Å; H486-Y489 PolarHBondContact O-N 3.48Å; H486-Y489 VanDerWaalsContact O-N 3.11Å
487	P	62.2	Low	75.6	Confident	104 Å²	104	67.8 Å²	67.8	68%	0.675	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-24.8	-178.7	23	-32.3	0	0	0	113.2
488	D	63.6	Low	75.7	Confident	162 Å²	162	68.2 Å²	68.2	87%	0.866	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-8	-179.1	-61.5	-30.4	0	0	0	113.9	H486	H486-D488 PolarHBondContact O-N 2.84Å; H486-D488 VanDerWaalsContact O-N 3.15Å
489	Y	65.9	Low	75.7	Confident	65 Å²	65	68.2 Å²	68.2	26%	0.255	37%	0.366	S	S	.	.			trans	-110.7	107.5	-174.3	-165.1	-101.1	0	0	0	111.7	R416 H486 N491 Y492	R416-Y489 VanDerWaalsContact NH1-CE1 3.33Å; R416-Y489 VanDerWaalsContact NH1-CG 3.31Å; R416-Y489 PolarHBondContact NH2-OH 3.29Å; H486-Y489 PolarHBondContact O-N 3.48Å; H486-Y489 VanDerWaalsContact O-N 3.11Å; Y489-N491 WeakPolarHBondContact CE1-O 3.35Å; Y489-N491 PolarHBondContact OH-O 3.02Å; Y489-Y492 HydrophobicContact CD1-CD1 4.18Å; Y489-Y492 AromaticContact CD1-CE1 3.9Å; Y489-Y492 HydrophobicContact CD1-CE1 3.9Å; Y489-Y492 HydrophobicContact CE1-CD1 4.26Å; Y489-Y492 HydrophobicContact CE1-CE1 4.42Å; Y489-Y492 WeakPolarHBondContact O-CE2 3.11Å; Y489-Y492 PolarHBondContact O-OH 2.51Å
490	T	62.7	Low	75.8	Confident	129 Å²	129	63.3 Å²	63.3	79%	0.791	34%	0.344	S	S	*	.			trans	-102.8	-3	-172.2	53.9	0	0	0	0	114.8
491	N	74.9	Confident	75.8	Confident	83 Å²	83	59.6 Å²	59.6	44%	0.444	33%	0.327	S	S	.	.			trans	-121.6	88.9	-171.5	-170	12.1	0	0	0	113.4	Y489 T493	Y489-N491 WeakPolarHBondContact CE1-O 3.35Å; Y489-N491 PolarHBondContact OH-O 3.02Å; N491-T493 VanDerWaalsContact C-N 3.33Å; N491-T493 PolarHBondContact O-N 2.85Å; N491-T493 VanDerWaalsContact OD1-CG2 3.26Å; N491-T493 WeakPolarHBondContact OD1-CG2 3.3Å; N491-T493 PolarHBondContact OD1-OG1 2.81Å; N491-T493 VanDerWaalsContact OD1-OG1 3.1Å
492	Y	76.7	Confident	76	Confident	19 Å²	19	58 Å²	58	8%	0.075	32%	0.32	C	S	.	.			trans	-88.2	16.2	-177.5	-66	-75.9	0	0	0	114.9	I478 E479 L482 Y489 D494 E495 V496	I478-Y492 HydrophobicContact CG2-CD1 3.46Å; I478-Y492 VanDerWaalsContact CG2-CD1 3.46Å; I478-Y492 HydrophobicContact CG2-CD2 3.85Å; I478-Y492 HydrophobicContact CG2-CE1 3.99Å; I478-Y492 HydrophobicContact CG2-CE2 4.36Å; I478-Y492 HydrophobicContact CG2-CG 3.37Å; E479-Y492 HydrophobicContact CG-CD2 4.48Å; L482-Y492 HydrophobicContact CB-CE1 4.14Å; L482-Y492 PolarHBondContact O-OH 2.82Å; Y489-Y492 HydrophobicContact CD1-CD1 4.18Å; Y489-Y492 AromaticContact CD1-CE1 3.9Å; Y489-Y492 HydrophobicContact CD1-CE1 3.9Å; Y489-Y492 HydrophobicContact CE1-CD1 4.26Å; Y489-Y492 HydrophobicContact CE1-CE1 4.42Å; Y489-Y492 WeakPolarHBondContact O-CE2 3.11Å; Y489-Y492 PolarHBondContact O-OH 2.51Å; Y492-D494 VanDerWaalsContact C-N 3.28Å; Y492-D494 PolarHBondContact O-N 3.04Å; Y492-E495 WeakPolarHBondContact CA-OE2 3.37Å; Y492-E495 HydrophobicContact CD1-CG 4.48Å; Y492-E495 PolarHBondContact O-N 3.02Å; Y492-E495 VanDerWaalsContact O-N 3.13Å; Y492-V496 VanDerWaalsContact O-CG2 3.3Å; Y492-V496 WeakPolarHBondContact O-CG2 3.24Å; Y492-V496 PolarHBondContact O-N 3.04Å
493	T	80.7	Confident	76.1	Confident	59 Å²	59	58.6 Å²	58.6	36%	0.362	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-36.9	-175.3	49.1	0	0	0	0	113.7	N491 N497	N491-T493 VanDerWaalsContact C-N 3.33Å; N491-T493 PolarHBondContact O-N 2.85Å; N491-T493 VanDerWaalsContact OD1-CG2 3.26Å; N491-T493 WeakPolarHBondContact OD1-CG2 3.3Å; N491-T493 PolarHBondContact OD1-OG1 2.81Å; N491-T493 VanDerWaalsContact OD1-OG1 3.1Å; T493-N497 WeakPolarHBondContact O-CB 3.47Å; T493-N497 VanDerWaalsContact O-CG 3.23Å; T493-N497 PolarHBondContact O-N 3.24Å; T493-N497 VanDerWaalsContact O-N 3.08Å; T493-N497 PolarHBondContact O-ND2 3.01Å
494	D	80.8	Confident	76.5	Confident	97 Å²	97	63.1 Å²	63.1	52%	0.519	34%	0.342	S	S	.	.	H	α-helix	trans	-68.4	-41.3	178.9	-69.7	-14.7	0	0	0	110.6	Y492 N497 M498	Y492-D494 VanDerWaalsContact C-N 3.28Å; Y492-D494 PolarHBondContact O-N 3.04Å; D494-N497 PolarHBondContact O-N 3.11Å; D494-M498 HydrophobicContact CB-CE 4.49Å; D494-M498 VanDerWaalsContact O-CG 3.31Å; D494-M498 WeakPolarHBondContact O-CG 3.29Å; D494-M498 PolarHBondContact O-N 2.95Å
495	E	83.5	Confident	76.9	Confident	5 Å²	5	62 Å²	62	2%	0.023	33%	0.332	C	S	.	.	H	α-helix	trans	-66.1	-41.1	177	-67.2	80.7	178.3	0	0	112.7	R416 L419 I478 Y492 M498 L499	R416-E495 HydrophobicContact CB-CG 4.46Å; R416-E495 IonicContact CZ-OE1 3.49Å; R416-E495 IonicContact NE-OE1 2.72Å; R416-E495 PolarHBondContact NE-OE1 3.14Å; R416-E495 IonicContact NH2-OE1 2.78Å; R416-E495 PolarHBondContact NH2-OE1 3.28Å; R416-E495 IonicContact NH2-OE2 2.85Å; L419-E495 HydrophobicContact CD2-CB 4.31Å; L419-E495 HydrophobicContact CD2-CG 4.39Å; I478-E495 HydrophobicContact CD1-CB 4.39Å; Y492-E495 WeakPolarHBondContact CA-OE2 3.37Å; Y492-E495 HydrophobicContact CD1-CG 4.48Å; Y492-E495 PolarHBondContact O-N 3.02Å; Y492-E495 VanDerWaalsContact O-N 3.13Å; E495-M498 HydrophobicContact CB-CE 4.34Å; E495-M498 HydrophobicContact CG-CE 3.96Å; E495-M498 PolarHBondContact O-N 2.94Å; E495-L499 WeakPolarHBondContact O-CB 3.4Å; E495-L499 PolarHBondContact O-N 2.61Å
496	V	84.7	Confident	77.5	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-44.9	174	175.8	0	0	0	0	110.4	E475 I478 Y492 L499 C500	E475-V496 HydrophobicContact CG-CG1 4.44Å; E475-V496 HydrophobicContact CG-CG2 3.54Å; I478-V496 HydrophobicContact CD1-CB 4.44Å; I478-V496 HydrophobicContact CD1-CG2 3.58Å; Y492-V496 VanDerWaalsContact O-CG2 3.3Å; Y492-V496 WeakPolarHBondContact O-CG2 3.24Å; Y492-V496 PolarHBondContact O-N 3.04Å; V496-L499 PolarHBondContact O-N 2.81Å; V496-C500 WeakPolarHBondContact O-CB 3.31Å; V496-C500 PolarHBondContact O-N 2.9Å; V496-C500 PolarHBondContact O-SG 2.86Å; V496-C500 VanDerWaalsContact O-SG 3.4Å
497	N	84.2	Confident	78.1	Confident	93 Å²	93	60.2 Å²	60.2	50%	0.497	32%	0.324	S	S	.	.	H	α-helix	trans	-62.6	-44.7	176.9	-73.6	-36.9	0	0	0	112.1	T493 D494 L499 C500 E501	T493-N497 WeakPolarHBondContact O-CB 3.47Å; T493-N497 VanDerWaalsContact O-CG 3.23Å; T493-N497 PolarHBondContact O-N 3.24Å; T493-N497 VanDerWaalsContact O-N 3.08Å; T493-N497 PolarHBondContact O-ND2 3.01Å; D494-N497 PolarHBondContact O-N 3.11Å; N497-L499 VanDerWaalsContact C-N 3.31Å; N497-L499 PolarHBondContact O-N 2.8Å; N497-C500 PolarHBondContact O-N 2.78Å; N497-E501 PolarHBondContact O-N 2.84Å
498	M	85	Confident	78.8	Confident	24 Å²	24	59 Å²	59	12%	0.118	31%	0.312	C	S	.	.	H	α-helix	trans	-58.9	-43	175.1	-74.6	-174	-75.1	0	0	111.3	L419 R420 Y423 D494 E495 E501 I502	L419-M498 HydrophobicContact CD2-CB 3.85Å; L419-M498 HydrophobicContact CD2-CE 3.81Å; L419-M498 HydrophobicContact CD2-SD 4.22Å; R420-M498 HydrophobicContact CB-SD 4.43Å; R420-M498 HydrophobicContact CG-SD 4.48Å; Y423-M498 HydrophobicContact CD1-CG 4.15Å; Y423-M498 HydrophobicContact CD1-SD 3.91Å; Y423-M498 HydrophobicContact CD2-CB 3.75Å; Y423-M498 HydrophobicContact CD2-CG 3.7Å; Y423-M498 HydrophobicContact CD2-SD 4.31Å; Y423-M498 HydrophobicContact CE1-CG 4.28Å; Y423-M498 HydrophobicContact CE1-SD 4.44Å; Y423-M498 HydrophobicContact CE2-CB 4.09Å; Y423-M498 HydrophobicContact CE2-CG 3.82Å; Y423-M498 HydrophobicContact CG-CB 4.22Å; Y423-M498 HydrophobicContact CG-CG 3.86Å; Y423-M498 HydrophobicContact CG-SD 3.84Å; D494-M498 HydrophobicContact CB-CE 4.49Å; D494-M498 VanDerWaalsContact O-CG 3.31Å; D494-M498 WeakPolarHBondContact O-CG 3.29Å; D494-M498 PolarHBondContact O-N 2.95Å; E495-M498 HydrophobicContact CB-CE 4.34Å; E495-M498 HydrophobicContact CG-CE 3.96Å; E495-M498 PolarHBondContact O-N 2.94Å; M498-E501 PolarHBondContact O-N 2.78Å; M498-I502 VanDerWaalsContact O-CG1 3.25Å; M498-I502 WeakPolarHBondContact O-CG1 3.4Å; M498-I502 PolarHBondContact O-N 3.19Å; M498-I502 VanDerWaalsContact O-N 3.07Å
499	L	84.4	Confident	79.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.9	-42	-179.9	-171.5	59.3	0	0	0	112.3	V445 L446 L474 I478 E495 V496 N497 E501 I502 I503	V445-L499 HydrophobicContact CG1-CD2 3.87Å; L446-L499 HydrophobicContact CD2-CD1 3.55Å; L446-L499 HydrophobicContact CG-CD1 4.46Å; L474-L499 HydrophobicContact CB-CD2 4.35Å; L474-L499 HydrophobicContact CD1-CD2 4.29Å; L474-L499 HydrophobicContact CD1-CG 4.33Å; L474-L499 HydrophobicContact CD2-CD2 3.73Å; L474-L499 HydrophobicContact CD2-CG 4.32Å; L474-L499 HydrophobicContact CG-CD2 4.33Å; I478-L499 HydrophobicContact CD1-CD2 4.29Å; E495-L499 WeakPolarHBondContact O-CB 3.4Å; E495-L499 PolarHBondContact O-N 2.61Å; V496-L499 PolarHBondContact O-N 2.81Å; N497-L499 VanDerWaalsContact C-N 3.31Å; N497-L499 PolarHBondContact O-N 2.8Å; L499-E501 VanDerWaalsContact C-N 3.34Å; L499-E501 PolarHBondContact O-N 3.5Å; L499-I502 PolarHBondContact O-N 2.85Å; L499-I503 HydrophobicContact CD1-CD1 4.18Å; L499-I503 HydrophobicContact CG-CD1 3.95Å; L499-I503 VanDerWaalsContact O-CG1 3.3Å; L499-I503 WeakPolarHBondContact O-CG1 3.42Å; L499-I503 PolarHBondContact O-N 3.22Å
500	C	84.4	Confident	80.6	Confident	17 Å²	17	49.7 Å²	49.7	12%	0.115	27%	0.267	C	S	.	.	H	α-helix	trans	-59.9	-41.5	173.9	-77.9	0	0	0	0	112.2	L474 V496 N497 I503 N504	L474-C500 VanDerWaalsContact CD1-SG 3.56Å; V496-C500 WeakPolarHBondContact O-CB 3.31Å; V496-C500 PolarHBondContact O-N 2.9Å; V496-C500 PolarHBondContact O-SG 2.86Å; V496-C500 VanDerWaalsContact O-SG 3.4Å; N497-C500 PolarHBondContact O-N 2.78Å; C500-I503 PolarHBondContact O-N 3.44Å; C500-N504 VanDerWaalsContact O-CB 3.32Å; C500-N504 WeakPolarHBondContact O-CB 3.48Å; C500-N504 VanDerWaalsContact O-CG 3.27Å; C500-N504 PolarHBondContact O-N 3.29Å; C500-N504 PolarHBondContact O-ND2 3.01Å; C500-N504 VanDerWaalsContact O-ND2 3.11Å
501	E	83.7	Confident	81.8	Confident	49 Å²	49	44.8 Å²	44.8	23%	0.229	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-42.8	176.9	-169.5	173.8	159.7	0	0	111.7	Y423 N497 M498 L499 I503 N504 E505	Y423-E501 HydrophobicContact CE2-CB 4.46Å; Y423-E501 PolarHBondContact OH-OE2 2.92Å; Y423-E501 VanDerWaalsContact OH-OE2 3.08Å; N497-E501 PolarHBondContact O-N 2.84Å; M498-E501 PolarHBondContact O-N 2.78Å; L499-E501 VanDerWaalsContact C-N 3.34Å; L499-E501 PolarHBondContact O-N 3.5Å; E501-I503 PolarHBondContact O-N 3.07Å; E501-N504 PolarHBondContact O-N 2.96Å; E501-E505 PolarHBondContact O-N 2.96Å
502	I	84	Confident	82.4	Confident	5 Å²	5	43 Å²	43	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-47.1	175.7	-69.3	167.2	0	0	0	111.1	Y423 M426 L446 M498 L499 Y506 T507 V510	Y423-I502 HydrophobicContact CD2-CD1 4.3Å; Y423-I502 HydrophobicContact CD2-CG1 4.32Å; M426-I502 HydrophobicContact CE-CG2 4.05Å; M426-I502 HydrophobicContact SD-CB 4.44Å; M426-I502 HydrophobicContact SD-CD1 4.07Å; M426-I502 HydrophobicContact SD-CG1 3.87Å; M426-I502 HydrophobicContact SD-CG2 3.77Å; L446-I502 HydrophobicContact CD2-CD1 4.44Å; M498-I502 VanDerWaalsContact O-CG1 3.25Å; M498-I502 WeakPolarHBondContact O-CG1 3.4Å; M498-I502 PolarHBondContact O-N 3.19Å; M498-I502 VanDerWaalsContact O-N 3.07Å; L499-I502 PolarHBondContact O-N 2.85Å; I502-Y506 CarbonylContact O-C 3.56Å; I502-Y506 WeakPolarHBondContact O-CA 3.34Å; I502-Y506 PolarHBondContact O-N 3.2Å; I502-T507 PolarHBondContact O-N 3.41Å; I502-V510 HydrophobicContact CG2-CG2 4.01Å
503	I	82.9	Confident	82.9	Confident	13 Å²	13	42.1 Å²	42.1	7%	0.067	23%	0.227	C	C	.	.	H	α-helix	trans	-67.5	-41.5	-178.5	-68.1	169.2	0	0	0	111.1	A453 L474 L499 C500 E501 T507	A453-I503 HydrophobicContact CB-CG2 3.57Å; L474-I503 HydrophobicContact CD1-CD1 4.23Å; L474-I503 HydrophobicContact CD2-CD1 4.09Å; L499-I503 HydrophobicContact CD1-CD1 4.18Å; L499-I503 HydrophobicContact CG-CD1 3.95Å; L499-I503 VanDerWaalsContact O-CG1 3.3Å; L499-I503 WeakPolarHBondContact O-CG1 3.42Å; L499-I503 PolarHBondContact O-N 3.22Å; C500-I503 PolarHBondContact O-N 3.44Å; E501-I503 PolarHBondContact O-N 3.07Å; I503-T507 PolarHBondContact O-OG1 3.18Å
504	N	80.6	Confident	83.1	Confident	121 Å²	121	40.2 Å²	40.2	65%	0.647	21%	0.214	S	C	*	.	H	α-helix	trans	-77.5	-40	-175.4	-71.8	-32.5	0	0	0	113.6	C500 E501	C500-N504 VanDerWaalsContact O-CB 3.32Å; C500-N504 WeakPolarHBondContact O-CB 3.48Å; C500-N504 VanDerWaalsContact O-CG 3.27Å; C500-N504 PolarHBondContact O-N 3.29Å; C500-N504 PolarHBondContact O-ND2 3.01Å; C500-N504 VanDerWaalsContact O-ND2 3.11Å; E501-N504 PolarHBondContact O-N 2.96Å
505	E	76.3	Confident	83	Confident	123 Å²	123	35.9 Å²	35.9	58%	0.575	19%	0.191	S	C	*	.	H	α-helix	trans	-104.2	-27.5	-172.4	-64.3	-165.4	172.8	0	0	114.4	E501	E501-E505 PolarHBondContact O-N 2.96Å
506	Y	78.4	Confident	82.6	Confident	32 Å²	32	40.6 Å²	40.6	13%	0.125	21%	0.213	C	C	.	.	H	α-helix	trans	-124	17.3	-166.9	-58.7	-78.6	0	0	0	114.3	I427 I502 N508 L509	I427-Y506 HydrophobicContact CG1-CE2 4.09Å; I502-Y506 CarbonylContact O-C 3.56Å; I502-Y506 WeakPolarHBondContact O-CA 3.34Å; I502-Y506 PolarHBondContact O-N 3.2Å; Y506-N508 PolarHBondContact O-N 3.14Å; Y506-L509 HydrophobicContact CD1-CD1 3.86Å; Y506-L509 WeakPolarHBondContact O-CB 3.41Å; Y506-L509 PolarHBondContact O-N 3.32Å
507	T	79.9	Confident	82.2	Confident	58 Å²	58	46.6 Å²	46.6	36%	0.356	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-51.6	-31.9	177.6	-81.1	0	0	0	0	113.2	L450 I502 I503 L509 V510	L450-T507 HydrophobicContact CD1-CG2 4.42Å; I502-T507 PolarHBondContact O-N 3.41Å; I503-T507 PolarHBondContact O-OG1 3.18Å; T507-L509 PolarHBondContact O-N 3.3Å; T507-V510 PolarHBondContact O-N 2.82Å
508	N	77.2	Confident	81.8	Confident	79 Å²	79	45 Å²	45	42%	0.422	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-72.3	-8.9	178.3	67.3	-50	0	0	0	114.8	Y506 S535	Y506-N508 PolarHBondContact O-N 3.14Å; N508-S535 PolarHBondContact ND2-OG 2.89Å
509	L	82.4	Confident	81.2	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-102.3	-4.4	177.7	-62.5	-178.3	0	0	0	112.9	R430 P432 I433 Y506 T507	R430-L509 HydrophobicContact CB-CD1 4.32Å; P432-L509 CarbonylContact C-O 3.58Å; P432-L509 VanDerWaalsContact CA-O 3.28Å; P432-L509 WeakPolarHBondContact CA-O 3.05Å; I433-L509 PolarHBondContact N-O 2.8Å; Y506-L509 HydrophobicContact CD1-CD1 3.86Å; Y506-L509 WeakPolarHBondContact O-CB 3.41Å; Y506-L509 PolarHBondContact O-N 3.32Å; T507-L509 PolarHBondContact O-N 3.3Å
510	V	85.6	Confident	80.8	Confident	20 Å²	20	49.7 Å²	49.7	12%	0.121	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.4	-176.6	-168.1	0	0	0	0	110.5	M426 I433 V435 L450 I502 T507	M426-V510 HydrophobicContact CE-CG2 3.46Å; M426-V510 VanDerWaalsContact CE-CG2 3.46Å; M426-V510 HydrophobicContact SD-CG2 4.43Å; I433-V510 WeakPolarHBondContact O-CA 3.09Å; V435-V510 HydrophobicContact CG2-CG1 3.85Å; L450-V510 HydrophobicContact CD2-CG1 4.28Å; I502-V510 HydrophobicContact CG2-CG2 4.01Å; T507-V510 PolarHBondContact O-N 2.82Å
511	S	87	Confident	80.7	Confident	26 Å²	26	49 Å²	49	18%	0.182	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	135.4	173.2	59.8	0	0	0	0	110.7	I433 V434 V435 S528	I433-S511 PolarHBondContact O-N 2.73Å; I433-S511 PolarHBondContact O-OG 2.66Å; V434-S511 CarbonylContact C-O 3.59Å; V434-S511 WeakPolarHBondContact CA-O 3.41Å; V434-S511 WeakPolarHBondContact CG2-OG 3.07Å; V435-S511 PolarHBondContact N-O 2.82Å; S511-S528 WeakPolarHBondContact OG-CB 3.3Å
512	V	87.7	Confident	80.5	Confident	47 Å²	47	47 Å²	47	29%	0.285	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.7	-179.2	-177.4	0	0	0	0	109.5	K437 A447 L450 Y524	K437-V512 HydrophobicContact CB-CG1 3.86Å; K437-V512 HydrophobicContact CD-CG1 4.32Å; A447-V512 HydrophobicContact CB-CG1 4Å; A447-V512 HydrophobicContact CB-CG2 4.46Å; L450-V512 HydrophobicContact CD2-CG2 3.87Å; V512-Y524 VanDerWaalsContact O-CE1 3.3Å; V512-Y524 WeakPolarHBondContact O-CE1 3.25Å
513	F	86.8	Confident	80.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	117.2	174.2	174.9	-114.1	0	0	0	109.1	I120 V434 V435 T436 K437 M515 D518 L521 Y524	I120-F513 HydrophobicContact CG2-CZ 4.44Å; V434-F513 HydrophobicContact CG1-CB 3.88Å; V435-F513 PolarHBondContact O-N 3.07Å; T436-F513 CarbonylContact C-O 3.46Å; T436-F513 WeakPolarHBondContact CA-O 3.41Å; T436-F513 HydrophobicContact CG2-CD1 4.03Å; K437-F513 PolarHBondContact N-O 3.24Å; F513-M515 HydrophobicContact CD1-CG 3.73Å; F513-M515 HydrophobicContact CE1-CB 4.27Å; F513-M515 HydrophobicContact CE1-CG 3.65Å; F513-M515 PolarHBondContact O-N 3.32Å; F513-D518 HydrophobicContact CD2-CB 4.13Å; F513-D518 HydrophobicContact CE2-CB 3.49Å; F513-D518 VanDerWaalsContact CE2-CB 3.49Å; F513-D518 HydrophobicContact CZ-CB 4.23Å; F513-D518 VanDerWaalsContact CZ-O 3.23Å; F513-D518 WeakPolarHBondContact CZ-O 3.48Å; F513-L521 HydrophobicContact CD1-CD1 3.63Å; F513-L521 HydrophobicContact CE1-CB 3.97Å; F513-L521 HydrophobicContact CE1-CD1 3.78Å; F513-L521 HydrophobicContact CE1-CG 4.4Å; F513-L521 HydrophobicContact CE2-CB 4.48Å; F513-L521 HydrophobicContact CG-CD1 4.1Å; F513-L521 HydrophobicContact CZ-CB 3.9Å; F513-L521 HydrophobicContact CZ-CD1 4.39Å; F513-Y524 HydrophobicContact CB-CD1 4.31Å; F513-Y524 HydrophobicContact CB-CG 4.31Å; F513-Y524 HydrophobicContact CD2-CD1 4.33Å; F513-Y524 AromaticContact CD2-CD2 3.41Å; F513-Y524 HydrophobicContact CD2-CD2 3.41Å; F513-Y524 VanDerWaalsContact CD2-CD2 3.41Å; F513-Y524 AromaticContact CD2-CE2 3.65Å; F513-Y524 HydrophobicContact CD2-CE2 3.65Å; F513-Y524 AromaticContact CD2-CG 3.76Å; F513-Y524 HydrophobicContact CD2-CG 3.76Å; F513-Y524 AromaticContact CE2-CD2 3.87Å; F513-Y524 HydrophobicContact CE2-CD2 3.87Å; F513-Y524 HydrophobicContact CE2-CE2 4.07Å; F513-Y524 HydrophobicContact CG-CD2 4.48Å; F513-Y524 HydrophobicContact CG-CG 4.45Å
514	D	85.5	Confident	79.9	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.102	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	105.5	176.2	-161.9	-40.4	0	0	0	109.8	K437 E516 E517 D518	K437-D514 IonicContact NZ-OD2 3.24Å; K437-D514 PolarHBondContact NZ-OD2 3.46Å; D514-E516 PolarHBondContact O-N 3.46Å; D514-E516 WeakPolarHBondContact OD1-CB 3.49Å; D514-E516 PolarHBondContact OD1-N 3.11Å; D514-E517 HydrophobicContact CB-CB 4.25Å; D514-E517 HydrophobicContact CB-CG 4.41Å; D514-E517 PolarHBondContact O-N 3.49Å; D514-D518 PolarHBondContact O-N 3Å
515	M	77.8	Confident	80	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.025	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-12.5	-177.6	-61.9	-169.1	65	0	0	113.4	L117 I120 F121 T436 K437 T439 F513	L117-M515 HydrophobicContact CB-CE 3.79Å; L117-M515 HydrophobicContact CD2-CB 3.4Å; L117-M515 VanDerWaalsContact CD2-CB 3.4Å; L117-M515 HydrophobicContact CD2-CE 3.75Å; L117-M515 HydrophobicContact CD2-CG 4.41Å; L117-M515 WeakPolarHBondContact CD2-O 3.22Å; L117-M515 HydrophobicContact CD2-SD 4.28Å; L117-M515 HydrophobicContact CG-CE 4.38Å; L117-M515 WeakPolarHBondContact O-CE 3.5Å; I120-M515 HydrophobicContact CB-CE 4.45Å; I120-M515 HydrophobicContact CG2-CE 4.43Å; F121-M515 HydrophobicContact CB-CE 4.45Å; T436-M515 HydrophobicContact CG2-CG 4.34Å; T436-M515 HydrophobicContact CG2-SD 4.3Å; K437-M515 PolarHBondContact O-N 2.8Å; T439-M515 HydrophobicContact CG2-CG 4.44Å; T439-M515 HydrophobicContact CG2-SD 3.42Å; T439-M515 WeakPolarHBondContact CG2-SD 3.23Å; F513-M515 HydrophobicContact CD1-CG 3.73Å; F513-M515 HydrophobicContact CE1-CB 4.27Å; F513-M515 HydrophobicContact CE1-CG 3.65Å; F513-M515 PolarHBondContact O-N 3.32Å
516	E	76.3	Confident	80.1	Confident	105 Å²	105	39.5 Å²	39.5	49%	0.491	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-34.2	177.2	-56.1	-162.8	159.7	0	0	111.9	K114 D514	K114-E516 IonicContact NZ-OE1 2.86Å; K114-E516 PolarHBondContact NZ-OE1 2.59Å; D514-E516 PolarHBondContact O-N 3.46Å; D514-E516 WeakPolarHBondContact OD1-CB 3.49Å; D514-E516 PolarHBondContact OD1-N 3.11Å
517	E	76.9	Confident	79.9	Confident	133 Å²	133	39.5 Å²	39.5	62%	0.621	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-41.3	-177.4	-60.1	-173.4	166.2	0	0	112.6	D514	D514-E517 HydrophobicContact CB-CB 4.25Å; D514-E517 HydrophobicContact CB-CG 4.41Å; D514-E517 PolarHBondContact O-N 3.49Å
518	D	74.3	Confident	79.8	Confident	58 Å²	58	37 Å²	37	31%	0.31	20%	0.2	S	C	.	.			trans	-112.5	143.8	-172.5	-72.4	-29	0	0	0	112.8	F513 D514 Y524	F513-D518 HydrophobicContact CD2-CB 4.13Å; F513-D518 HydrophobicContact CE2-CB 3.49Å; F513-D518 VanDerWaalsContact CE2-CB 3.49Å; F513-D518 HydrophobicContact CZ-CB 4.23Å; F513-D518 VanDerWaalsContact CZ-O 3.23Å; F513-D518 WeakPolarHBondContact CZ-O 3.48Å; D514-D518 PolarHBondContact O-N 3Å; D518-Y524 HydrophobicContact CB-CE2 4.33Å; D518-Y524 VanDerWaalsContact OD2-CE2 3.29Å; D518-Y524 WeakPolarHBondContact OD2-CE2 3.32Å; D518-Y524 PolarHBondContact OD2-OH 3.46Å
519	S	72.4	Confident	79.8	Confident	60 Å²	60	33.7 Å²	33.7	42%	0.42	18%	0.182	S	C	.	.			trans	-108.9	-5.7	175.6	65.5	0	0	0	0	114.1	L521	S519-L521 PolarHBondContact O-N 2.73Å
520	D	76.3	Confident	79.4	Confident	64 Å²	64	33.4 Å²	33.4	34%	0.342	18%	0.181	S	C	.	.			trans	-96.7	61.1	-172.3	-157.1	51.4	0	0	0	113	K127 D522 G523 Y524	K127-D520 IonicContact NZ-OD1 2.63Å; K127-D520 PolarHBondContact NZ-OD1 2.85Å; D520-D522 PolarHBondContact O-N 2.8Å; D520-G523 PolarHBondContact O-N 2.97Å; D520-G523 VanDerWaalsContact O-N 3.13Å; D520-Y524 PolarHBondContact O-N 3.5Å
521	L	82.3	Confident	78.6	Confident	3 Å²	3	35 Å²	35	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-55.3	-37.6	-178.8	177.1	61.7	0	0	0	112.9	F121 L410 V434 T436 F513 S519 Y524 V525	F121-L521 HydrophobicContact CD2-CD2 4.3Å; L410-L521 HydrophobicContact CD1-CD1 3.88Å; L410-L521 HydrophobicContact CD2-CD2 4.14Å; V434-L521 HydrophobicContact CG1-CD1 4.43Å; T436-L521 HydrophobicContact CG2-CD1 4.47Å; F513-L521 HydrophobicContact CD1-CD1 3.63Å; F513-L521 HydrophobicContact CE1-CB 3.97Å; F513-L521 HydrophobicContact CE1-CD1 3.78Å; F513-L521 HydrophobicContact CE1-CG 4.4Å; F513-L521 HydrophobicContact CE2-CB 4.48Å; F513-L521 HydrophobicContact CG-CD1 4.1Å; F513-L521 HydrophobicContact CZ-CB 3.9Å; F513-L521 HydrophobicContact CZ-CD1 4.39Å; S519-L521 PolarHBondContact O-N 2.73Å; L521-Y524 PolarHBondContact O-N 2.79Å; L521-V525 WeakPolarHBondContact O-CG2 3.49Å; L521-V525 PolarHBondContact O-N 2.91Å; L521-V525 VanDerWaalsContact O-N 3.07Å
522	D	78.8	Confident	77.6	Confident	6 Å²	6	35.1 Å²	35.1	3%	0.032	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-37.4	179.1	57.5	-62.4	0	0	0	112.9	K127 D520 Y524 V525 I526 R555	K127-D522 HydrophobicContact CB-CB 4.09Å; K127-D522 HydrophobicContact CD-CB 4.25Å; K127-D522 WeakPolarHBondContact CD-OD1 2.99Å; K127-D522 VanDerWaalsContact CD-OD2 3.31Å; K127-D522 WeakPolarHBondContact CD-OD2 3.34Å; K127-D522 IonicContact NZ-OD1 2.87Å; K127-D522 PolarHBondContact NZ-OD1 2.86Å; K127-D522 IonicContact NZ-OD2 3.57Å; D520-D522 PolarHBondContact O-N 2.8Å; D522-Y524 VanDerWaalsContact C-N 3.31Å; D522-Y524 PolarHBondContact O-N 2.93Å; D522-V525 PolarHBondContact O-N 2.98Å; D522-I526 VanDerWaalsContact O-CG1 3.31Å; D522-I526 WeakPolarHBondContact O-CG1 3.39Å; D522-I526 PolarHBondContact O-N 2.91Å; D522-R555 IonicContact OD2-CZ 2.66Å; D522-R555 IonicContact OD2-NH1 3.52Å; D522-R555 PolarHBondContact OD2-NH1 2.94Å; D522-R555 IonicContact OD2-NH2 2.67Å; D522-R555 PolarHBondContact OD2-NH2 3.05Å
523	G	76.3	Confident	76.3	Confident	10 Å²	10	33.3 Å²	33.3	10%	0.103	19%	0.186	C	C	.	.	H	α-helix	trans	-59.2	-42	173.8	0	0	0	0	0	111.7	D520 I526 S527	D520-G523 PolarHBondContact O-N 2.97Å; D520-G523 VanDerWaalsContact O-N 3.13Å; G523-I526 PolarHBondContact O-N 2.69Å; G523-S527 VanDerWaalsContact O-CB 3.23Å; G523-S527 WeakPolarHBondContact O-CB 3.39Å; G523-S527 PolarHBondContact O-N 2.79Å; G523-S527 PolarHBondContact O-OG 3.07Å
524	Y	80.1	Confident	74.7	Confident	73 Å²	73	35 Å²	35	29%	0.286	20%	0.204	S	C	.	.	H	α-helix	trans	-68.4	-42.4	176.4	-83.8	-97.1	0	0	0	113	V512 F513 D518 D520 L521 D522 I526 S527 S528	V512-Y524 VanDerWaalsContact O-CE1 3.3Å; V512-Y524 WeakPolarHBondContact O-CE1 3.25Å; F513-Y524 HydrophobicContact CB-CD1 4.31Å; F513-Y524 HydrophobicContact CB-CG 4.31Å; F513-Y524 HydrophobicContact CD2-CD1 4.33Å; F513-Y524 AromaticContact CD2-CD2 3.41Å; F513-Y524 HydrophobicContact CD2-CD2 3.41Å; F513-Y524 VanDerWaalsContact CD2-CD2 3.41Å; F513-Y524 AromaticContact CD2-CE2 3.65Å; F513-Y524 HydrophobicContact CD2-CE2 3.65Å; F513-Y524 AromaticContact CD2-CG 3.76Å; F513-Y524 HydrophobicContact CD2-CG 3.76Å; F513-Y524 AromaticContact CE2-CD2 3.87Å; F513-Y524 HydrophobicContact CE2-CD2 3.87Å; F513-Y524 HydrophobicContact CE2-CE2 4.07Å; F513-Y524 HydrophobicContact CG-CD2 4.48Å; F513-Y524 HydrophobicContact CG-CG 4.45Å; D518-Y524 HydrophobicContact CB-CE2 4.33Å; D518-Y524 VanDerWaalsContact OD2-CE2 3.29Å; D518-Y524 WeakPolarHBondContact OD2-CE2 3.32Å; D518-Y524 PolarHBondContact OD2-OH 3.46Å; D520-Y524 PolarHBondContact O-N 3.5Å; L521-Y524 PolarHBondContact O-N 2.79Å; D522-Y524 VanDerWaalsContact C-N 3.31Å; D522-Y524 PolarHBondContact O-N 2.93Å; Y524-I526 VanDerWaalsContact C-N 3.31Å; Y524-I526 PolarHBondContact O-N 2.91Å; Y524-S527 WeakPolarHBondContact O-CB 3.22Å; Y524-S527 PolarHBondContact O-N 2.96Å; Y524-S528 PolarHBondContact O-N 3.17Å; Y524-S528 PolarHBondContact O-OG 3.48Å
525	V	81.8	Confident	73.3	Confident	8 Å²	8	36.6 Å²	36.6	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-43.8	174.1	170.6	0	0	0	0	111.2	C408 V434 L521 D522 S528 L529	C408-V525 HydrophobicContact CB-CG1 4.06Å; V434-V525 HydrophobicContact CG2-CG2 4.16Å; L521-V525 WeakPolarHBondContact O-CG2 3.49Å; L521-V525 PolarHBondContact O-N 2.91Å; L521-V525 VanDerWaalsContact O-N 3.07Å; D522-V525 PolarHBondContact O-N 2.98Å; V525-S528 PolarHBondContact O-OG 3.15Å; V525-L529 HydrophobicContact CG1-CD1 4.36Å; V525-L529 VanDerWaalsContact O-CG 3.26Å; V525-L529 WeakPolarHBondContact O-CG 3.42Å; V525-L529 PolarHBondContact O-N 3.11Å
526	I	77.7	Confident	72.2	Confident	13 Å²	13	40.5 Å²	40.5	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-73.5	-34.8	178.9	-60.2	174.4	0	0	0	111	D522 G523 Y524 S528 L529 L530 L553 R555 I558	D522-I526 VanDerWaalsContact O-CG1 3.31Å; D522-I526 WeakPolarHBondContact O-CG1 3.39Å; D522-I526 PolarHBondContact O-N 2.91Å; G523-I526 PolarHBondContact O-N 2.69Å; Y524-I526 VanDerWaalsContact C-N 3.31Å; Y524-I526 PolarHBondContact O-N 2.91Å; I526-S528 PolarHBondContact O-N 3.01Å; I526-L529 WeakPolarHBondContact O-CB 3.38Å; I526-L529 PolarHBondContact O-N 3.38Å; I526-L530 HydrophobicContact CG2-CD1 4.06Å; I526-L530 HydrophobicContact CG2-CG 4.3Å; I526-L530 VanDerWaalsContact O-CG 3.27Å; I526-L530 WeakPolarHBondContact O-CG 3.35Å; I526-L530 PolarHBondContact O-N 3.33Å; I526-L553 HydrophobicContact CD1-CD1 4.21Å; I526-L553 HydrophobicContact CG1-CD1 4.01Å; I526-L553 HydrophobicContact CG2-CD1 4.15Å; I526-R555 HydrophobicContact CD1-CB 4.49Å; I526-R555 HydrophobicContact CD1-CG 3.74Å; I526-I558 HydrophobicContact CB-CD1 3.72Å; I526-I558 HydrophobicContact CD1-CD1 3.6Å; I526-I558 HydrophobicContact CG1-CD1 4.26Å; I526-I558 HydrophobicContact CG2-CD1 3.55Å; I526-I558 HydrophobicContact CG2-CG2 4.12Å
527	S	74.1	Confident	71.2	Confident	32 Å²	32	36.6 Å²	36.6	22%	0.224	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-43.8	176.2	-64.9	0	0	0	0	112.8	G523 Y524 L530 A531 K562	G523-S527 VanDerWaalsContact O-CB 3.23Å; G523-S527 WeakPolarHBondContact O-CB 3.39Å; G523-S527 PolarHBondContact O-N 2.79Å; G523-S527 PolarHBondContact O-OG 3.07Å; Y524-S527 WeakPolarHBondContact O-CB 3.22Å; Y524-S527 PolarHBondContact O-N 2.96Å; S527-L530 PolarHBondContact O-N 3.37Å; S527-A531 WeakPolarHBondContact O-CB 3.32Å; S527-A531 PolarHBondContact O-N 3.37Å; S527-K562 PolarHBondContact OG-NZ 3.49Å
528	S	78	Confident	70	Confident	7 Å²	7	32.3 Å²	32.3	5%	0.049	21%	0.212	C	C	.	.	H	α-helix	trans	-68.2	-38.5	177.9	69.6	0	0	0	0	111.5	C408 V434 S511 Y524 V525 I526 L530 A531 S532	C408-S528 PolarHBondContact SG-OG 3.06Å; C408-S528 VanDerWaalsContact SG-OG 3.37Å; V434-S528 WeakPolarHBondContact CG2-OG 3.42Å; S511-S528 WeakPolarHBondContact OG-CB 3.3Å; Y524-S528 PolarHBondContact O-N 3.17Å; Y524-S528 PolarHBondContact O-OG 3.48Å; V525-S528 PolarHBondContact O-OG 3.15Å; I526-S528 PolarHBondContact O-N 3.01Å; S528-L530 PolarHBondContact O-N 3.49Å; S528-A531 PolarHBondContact O-N 3.14Å; S528-S532 WeakPolarHBondContact O-CB 3.35Å; S528-S532 PolarHBondContact O-N 3.35Å
529	L	77.2	Confident	69	Low	8 Å²	8	33.9 Å²	33.9	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-59.1	-44.8	171.4	-72.6	170.9	0	0	0	112.2	L102 P406 M407 C408 P432 V525 I526 S532 A533 L553	L102-L529 HydrophobicContact CD1-CD1 3.56Å; L102-L529 HydrophobicContact CD1-CD2 4.45Å; P406-L529 HydrophobicContact CB-CD2 3.95Å; M407-L529 WeakPolarHBondContact O-CD2 3.27Å; C408-L529 HydrophobicContact CB-CD1 4.4Å; C408-L529 HydrophobicContact CB-CD2 3.82Å; C408-L529 HydrophobicContact CB-CG 3.99Å; P432-L529 HydrophobicContact CG-CD2 4.1Å; V525-L529 HydrophobicContact CG1-CD1 4.36Å; V525-L529 VanDerWaalsContact O-CG 3.26Å; V525-L529 WeakPolarHBondContact O-CG 3.42Å; V525-L529 PolarHBondContact O-N 3.11Å; I526-L529 WeakPolarHBondContact O-CB 3.38Å; I526-L529 PolarHBondContact O-N 3.38Å; L529-S532 PolarHBondContact O-N 3.18Å; L529-A533 PolarHBondContact O-N 3.23Å; L529-L553 HydrophobicContact CD1-CD1 4.5Å
530	L	73.9	Confident	68.2	Low	5 Å²	5	35.9 Å²	35.9	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-69.2	-36.5	179.2	-67.9	173.5	0	0	0	112.5	I526 S527 S528 S532 A533 Q546 I549 T550 I558 K562	I526-L530 HydrophobicContact CG2-CD1 4.06Å; I526-L530 HydrophobicContact CG2-CG 4.3Å; I526-L530 VanDerWaalsContact O-CG 3.27Å; I526-L530 WeakPolarHBondContact O-CG 3.35Å; I526-L530 PolarHBondContact O-N 3.33Å; S527-L530 PolarHBondContact O-N 3.37Å; S528-L530 PolarHBondContact O-N 3.49Å; L530-S532 VanDerWaalsContact C-N 3.33Å; L530-A533 PolarHBondContact O-N 3.41Å; L530-Q546 HydrophobicContact CB-CG 4.5Å; L530-Q546 HydrophobicContact CD2-CB 3.76Å; L530-Q546 HydrophobicContact CD2-CG 3.88Å; L530-Q546 PolarHBondContact O-NE2 3.49Å; L530-I549 HydrophobicContact CD2-CB 4.44Å; L530-I549 HydrophobicContact CD2-CG2 4.43Å; L530-T550 HydrophobicContact CD1-CG2 4.02Å; L530-T550 HydrophobicContact CD2-CG2 3.92Å; L530-I558 HydrophobicContact CD1-CG2 3.43Å; L530-I558 VanDerWaalsContact CD1-CG2 3.43Å; L530-K562 HydrophobicContact CD1-CD 3.94Å
531	A	69.6	Low	67.6	Low	54 Å²	54	35.7 Å²	35.7	45%	0.446	23%	0.23	S	C	.	.	H	α-helix	trans	-64.2	-39	174.1	0	0	0	0	0	111.6	S527 S528 A533 G534	S527-A531 WeakPolarHBondContact O-CB 3.32Å; S527-A531 PolarHBondContact O-N 3.37Å; S528-A531 PolarHBondContact O-N 3.14Å; A531-A533 PolarHBondContact O-N 3.19Å; A531-G534 WeakPolarHBondContact O-CA 3.49Å; A531-G534 PolarHBondContact O-N 2.82Å
532	S	66.8	Low	66.6	Low	27 Å²	27	37 Å²	37	19%	0.189	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-33	178.8	-170.3	0	0	0	0	113.6	S528 L529 L530 G534 S535	S528-S532 WeakPolarHBondContact O-CB 3.35Å; S528-S532 PolarHBondContact O-N 3.35Å; L529-S532 PolarHBondContact O-N 3.18Å; L530-S532 VanDerWaalsContact C-N 3.33Å; S532-G534 PolarHBondContact O-N 2.89Å; S532-S535 PolarHBondContact O-N 2.79Å
533	A	59.1	Low	66.2	Low	9 Å²	9	38.8 Å²	38.8	7%	0.074	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.5	171	0	0	0	0	0	113.1	L529 L530 A531 S535 Q546 I549	L529-A533 PolarHBondContact O-N 3.23Å; L530-A533 PolarHBondContact O-N 3.41Å; A531-A533 PolarHBondContact O-N 3.19Å; A533-S535 VanDerWaalsContact C-N 3.28Å; A533-S535 PolarHBondContact O-N 3.34Å; A533-Q546 HydrophobicContact CB-CG 3.85Å; A533-I549 HydrophobicContact CB-CD1 4.29Å
534	G	53.3	Low	66.1	Low	36 Å²	36	40 Å²	40	37%	0.371	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-7.6	178.8	0	0	0	0	0	116	A531 S532	A531-G534 WeakPolarHBondContact O-CA 3.49Å; A531-G534 PolarHBondContact O-N 2.82Å; S532-G534 PolarHBondContact O-N 2.89Å
535	S	55.7	Low	65.6	Low	53 Å²	53	39.4 Å²	39.4	37%	0.371	25%	0.25	S	C	.	.	S	Bend	trans	-106.1	-31.4	-160.4	-169.7	0	0	0	0	115.9	N508 S532 A533	N508-S535 PolarHBondContact ND2-OG 2.89Å; S532-S535 PolarHBondContact O-N 2.79Å; A533-S535 VanDerWaalsContact C-N 3.28Å; A533-S535 PolarHBondContact O-N 3.34Å
536	T	54.9	Low	65.3	Low	87 Å²	87	40.3 Å²	40.3	53%	0.534	25%	0.254	S	S	.	.	S	Bend	trans	-105.4	-8.6	-168.3	49.9	0	0	0	0	115.7
537	V	55	Low	65.4	Low	23 Å²	23	39.7 Å²	39.7	14%	0.139	25%	0.251	C	S	.	.	S	Bend	trans	-127.2	152.2	-165.6	-158.3	0	0	0	0	111.3	Q541 I542 E545	V537-Q541 HydrophobicContact CB-CB 4.42Å; V537-Q541 HydrophobicContact CG1-CB 3.42Å; V537-Q541 VanDerWaalsContact CG1-CB 3.42Å; V537-Q541 HydrophobicContact CG1-CG 4.23Å; V537-Q541 VanDerWaalsContact CG1-OE1 3.26Å; V537-I542 HydrophobicContact CB-CG1 4.43Å; V537-I542 WeakPolarHBondContact O-CD1 3.21Å; V537-I542 WeakPolarHBondContact O-CG1 3.07Å; V537-E545 WeakPolarHBondContact CG2-OE2 3.33Å
538	A	51.6	Low	65.5	Low	43 Å²	43	40.3 Å²	40.3	36%	0.355	25%	0.25	S	C	.	.			trans	-56	145	177.6	0	0	0	0	0	111.7	D540 Q541 I542	A538-D540 PolarHBondContact O-N 3.13Å; A538-Q541 PolarHBondContact O-N 3.03Å; A538-I542 PolarHBondContact O-N 2.7Å
539	S	53.6	Low	65.4	Low	90 Å²	90	41.3 Å²	41.3	63%	0.629	26%	0.255	S	S	*	.	H	α-helix	trans	-52.9	-26.9	-171.2	-43.9	0	0	0	0	115.7	N543	S539-N543 PolarHBondContact O-ND2 3.13Å
540	D	56.7	Low	65.5	Low	103 Å²	103	41 Å²	41	55%	0.551	25%	0.253	S	S	*	.	H	α-helix	trans	-75.8	-27.3	176.7	-85.6	19.6	0	0	0	113.1	A538 K571	A538-D540 PolarHBondContact O-N 3.13Å; D540-K571 IonicContact OD2-NZ 2.96Å; D540-K571 PolarHBondContact OD2-NZ 2.61Å
541	Q	62.1	Low	65.8	Low	60 Å²	60	40.8 Å²	40.8	28%	0.28	25%	0.252	S	S	.	.	H	α-helix	trans	-93.4	-29.3	-176.1	-76.1	174.2	-52.9	0	0	113.1	E401 V537 A538 N543 L544 E545	E401-Q541 PolarHBondContact OE1-NE2 3.04Å; V537-Q541 HydrophobicContact CB-CB 4.42Å; V537-Q541 HydrophobicContact CG1-CB 3.42Å; V537-Q541 VanDerWaalsContact CG1-CB 3.42Å; V537-Q541 HydrophobicContact CG1-CG 4.23Å; V537-Q541 VanDerWaalsContact CG1-OE1 3.26Å; A538-Q541 PolarHBondContact O-N 3.03Å; Q541-N543 PolarHBondContact O-N 2.75Å; Q541-N543 VanDerWaalsContact O-N 3.11Å; Q541-L544 WeakPolarHBondContact O-CB 3.44Å; Q541-L544 PolarHBondContact O-N 3.35Å; Q541-E545 PolarHBondContact O-N 2.95Å
542	I	62.4	Low	66	Low	29 Å²	29	40.5 Å²	40.5	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-47.8	-44.8	176.9	-64.8	173.5	0	0	0	111.7	V537 A538 L544 E545 Q546	V537-I542 HydrophobicContact CB-CG1 4.43Å; V537-I542 WeakPolarHBondContact O-CD1 3.21Å; V537-I542 WeakPolarHBondContact O-CG1 3.07Å; A538-I542 PolarHBondContact O-N 2.7Å; I542-L544 VanDerWaalsContact C-N 3.29Å; I542-L544 PolarHBondContact O-N 3.49Å; I542-E545 PolarHBondContact O-N 3.45Å; I542-Q546 HydrophobicContact CG2-CG 4.44Å; I542-Q546 WeakPolarHBondContact O-CB 2.95Å; I542-Q546 VanDerWaalsContact O-CG 3.3Å; I542-Q546 WeakPolarHBondContact O-CG 3.37Å; I542-Q546 PolarHBondContact O-N 2.78Å
543	N	69.7	Low	66.3	Low	44 Å²	44	39.9 Å²	39.9	24%	0.235	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-26.5	-176.3	-72.4	-58.4	0	0	0	114.1	S539 Q541 L547 K568 W570	S539-N543 PolarHBondContact O-ND2 3.13Å; Q541-N543 PolarHBondContact O-N 2.75Å; Q541-N543 VanDerWaalsContact O-N 3.11Å; N543-L547 WeakPolarHBondContact O-CB 3.02Å; N543-L547 PolarHBondContact O-N 2.76Å; N543-K568 WeakPolarHBondContact OD1-CE 3.36Å; N543-K568 PolarHBondContact OD1-NZ 2.83Å; N543-W570 HydrophobicContact CB-CH2 4.3Å
544	L	74.1	Confident	67.2	Low	36 Å²	36	42.9 Å²	42.9	19%	0.188	25%	0.254	C	S	.	.	H	α-helix	trans	-81.4	-41.9	179.9	-67.4	171.3	0	0	0	110.1	Q541 I542 L547 E548 W570 Y578	Q541-L544 WeakPolarHBondContact O-CB 3.44Å; Q541-L544 PolarHBondContact O-N 3.35Å; I542-L544 VanDerWaalsContact C-N 3.29Å; I542-L544 PolarHBondContact O-N 3.49Å; L544-L547 PolarHBondContact O-N 3.35Å; L544-E548 PolarHBondContact O-N 2.81Å; L544-W570 HydrophobicContact CD2-CZ3 4.07Å; L544-Y578 WeakPolarHBondContact CB-OH 3.35Å; L544-Y578 HydrophobicContact CD2-CE2 3.75Å; L544-Y578 PolarHBondContact O-OH 3.15Å
545	E	69.6	Low	68.4	Low	60 Å²	60	43.4 Å²	43.4	28%	0.28	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-44.5	173.4	-67	-174.9	169	0	0	111.5	V537 Q541 I542 L547 E548 I549	V537-E545 WeakPolarHBondContact CG2-OE2 3.33Å; Q541-E545 PolarHBondContact O-N 2.95Å; I542-E545 PolarHBondContact O-N 3.45Å; E545-L547 VanDerWaalsContact C-N 3.26Å; E545-L547 PolarHBondContact O-N 3.15Å; E545-E548 WeakPolarHBondContact O-CB 3.17Å; E545-E548 PolarHBondContact O-N 2.75Å; E545-E548 VanDerWaalsContact O-N 3.16Å; E545-I549 WeakPolarHBondContact O-CG1 3.4Å; E545-I549 PolarHBondContact O-N 2.92Å
546	Q	76	Confident	69.7	Low	28 Å²	28	41.2 Å²	41.2	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-58.3	-39.1	173	-75.3	177.5	-15.6	0	0	112.2	L530 A533 I542 T550 I563	L530-Q546 HydrophobicContact CB-CG 4.5Å; L530-Q546 HydrophobicContact CD2-CB 3.76Å; L530-Q546 HydrophobicContact CD2-CG 3.88Å; L530-Q546 PolarHBondContact O-NE2 3.49Å; A533-Q546 HydrophobicContact CB-CG 3.85Å; I542-Q546 HydrophobicContact CG2-CG 4.44Å; I542-Q546 WeakPolarHBondContact O-CB 2.95Å; I542-Q546 VanDerWaalsContact O-CG 3.3Å; I542-Q546 WeakPolarHBondContact O-CG 3.37Å; I542-Q546 PolarHBondContact O-N 2.78Å; Q546-T550 PolarHBondContact O-N 3.35Å; Q546-T550 PolarHBondContact O-OG1 2.89Å; Q546-T550 VanDerWaalsContact O-OG1 3.07Å; Q546-I563 VanDerWaalsContact C-CD1 3.47Å; Q546-I563 HydrophobicContact CB-CD1 3.93Å; Q546-I563 HydrophobicContact CB-CG1 4.23Å; Q546-I563 WeakPolarHBondContact O-CD1 3.43Å
547	L	80.6	Confident	71	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.5	-36.8	177.8	-176.3	61.6	0	0	0	111.7	N543 L544 E545 T550 L551 I563 F564 W570 L575 Y578 F590 F594	N543-L547 WeakPolarHBondContact O-CB 3.02Å; N543-L547 PolarHBondContact O-N 2.76Å; L544-L547 PolarHBondContact O-N 3.35Å; E545-L547 VanDerWaalsContact C-N 3.26Å; E545-L547 PolarHBondContact O-N 3.15Å; L547-T550 WeakPolarHBondContact CA-OG1 3.27Å; L547-T550 PolarHBondContact O-OG1 3.06Å; L547-L551 WeakPolarHBondContact O-CB 3.48Å; L547-L551 PolarHBondContact O-N 3.12Å; L547-I563 HydrophobicContact CB-CD1 4.29Å; L547-I563 HydrophobicContact CB-CG2 4.43Å; L547-I563 HydrophobicContact CD1-CD1 4.35Å; L547-F564 HydrophobicContact CD1-CE2 3.79Å; L547-F564 HydrophobicContact CD1-CZ 4.13Å; L547-F564 HydrophobicContact CD2-CZ 4.33Å; L547-W570 HydrophobicContact CD2-CH2 4.46Å; L547-L575 HydrophobicContact CD2-CD2 3.61Å; L547-Y578 HydrophobicContact CD2-CD1 4.21Å; L547-Y578 HydrophobicContact CD2-CD2 4.07Å; L547-Y578 HydrophobicContact CD2-CE2 4.48Å; L547-Y578 HydrophobicContact CD2-CG 3.92Å; L547-Y578 HydrophobicContact CG-CD1 4.2Å; L547-Y578 HydrophobicContact CG-CE1 4.5Å; L547-Y578 HydrophobicContact CG-CG 4.4Å; L547-F590 HydrophobicContact CD1-CE1 4.33Å; L547-F594 HydrophobicContact CD1-CE1 4.04Å; L547-F594 HydrophobicContact CD1-CZ 4.31Å; L547-F594 HydrophobicContact CD2-CE1 4.28Å; L547-F594 HydrophobicContact CD2-CZ 4.42Å
548	E	75.9	Confident	72.1	Confident	44 Å²	44	39.4 Å²	39.4	21%	0.206	22%	0.216	C	C	.	.	H	α-helix	trans	-64.8	-43.5	175.3	-165.6	167.5	-179.4	0	0	112	I403 L544 E545 L551 T552 Y578	I403-E548 WeakPolarHBondContact CD1-OE1 3.37Å; L544-E548 PolarHBondContact O-N 2.81Å; E545-E548 WeakPolarHBondContact O-CB 3.17Å; E545-E548 PolarHBondContact O-N 2.75Å; E545-E548 VanDerWaalsContact O-N 3.16Å; E548-L551 PolarHBondContact O-N 3.02Å; E548-T552 WeakPolarHBondContact O-CB 3.3Å; E548-T552 VanDerWaalsContact O-CG2 3.29Å; E548-T552 WeakPolarHBondContact O-CG2 3.38Å; E548-T552 PolarHBondContact O-N 3.12Å; E548-T552 PolarHBondContact O-OG1 2.85Å; E548-Y578 HydrophobicContact CB-CE1 3.91Å; E548-Y578 HydrophobicContact CG-CE1 4.35Å
549	I	76.4	Confident	73.6	Confident	29 Å²	29	37.4 Å²	37.4	15%	0.149	20%	0.199	C	C	.	.	H	α-helix	trans	-62.4	-48.1	176.1	-65.5	165.8	0	0	0	110.3	L530 A533 E545 L551 T552 L553	L530-I549 HydrophobicContact CD2-CB 4.44Å; L530-I549 HydrophobicContact CD2-CG2 4.43Å; A533-I549 HydrophobicContact CB-CD1 4.29Å; E545-I549 WeakPolarHBondContact O-CG1 3.4Å; E545-I549 PolarHBondContact O-N 2.92Å; I549-L551 VanDerWaalsContact C-N 3.34Å; I549-L551 PolarHBondContact O-N 3.26Å; I549-T552 WeakPolarHBondContact CA-OG1 3.27Å; I549-T552 PolarHBondContact O-N 3.2Å; I549-T552 PolarHBondContact O-OG1 2.82Å; I549-L553 HydrophobicContact CG2-CD1 3.72Å; I549-L553 HydrophobicContact CG2-CG 4.37Å; I549-L553 WeakPolarHBondContact O-CB 3.19Å; I549-L553 VanDerWaalsContact O-CG 3.23Å; I549-L553 WeakPolarHBondContact O-CG 3.27Å; I549-L553 PolarHBondContact O-N 2.74Å
550	T	79.4	Confident	75	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-37.9	178.1	50.4	0	0	0	0	112.6	L530 Q546 L547 L553 N554 R555 I558 A559 I563 F590	L530-T550 HydrophobicContact CD1-CG2 4.02Å; L530-T550 HydrophobicContact CD2-CG2 3.92Å; Q546-T550 PolarHBondContact O-N 3.35Å; Q546-T550 PolarHBondContact O-OG1 2.89Å; Q546-T550 VanDerWaalsContact O-OG1 3.07Å; L547-T550 WeakPolarHBondContact CA-OG1 3.27Å; L547-T550 PolarHBondContact O-OG1 3.06Å; T550-L553 PolarHBondContact O-N 2.98Å; T550-N554 PolarHBondContact O-N 2.93Å; T550-R555 PolarHBondContact O-N 2.91Å; T550-I558 HydrophobicContact CG2-CG2 4.33Å; T550-A559 HydrophobicContact CG2-CB 4.29Å; T550-I563 HydrophobicContact CG2-CD1 3.72Å; T550-I563 WeakPolarHBondContact OG1-CD1 3.23Å; T550-F590 VanDerWaalsContact C-CZ 3.45Å; T550-F590 VanDerWaalsContact O-CZ 3.23Å; T550-F590 WeakPolarHBondContact O-CZ 3.46Å
551	L	80	Confident	76.1	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-68	-39.3	177.9	-173.8	68.7	0	0	0	112.4	L547 E548 I549 N554 Y578 Q581 A582 R587 F590	L547-L551 WeakPolarHBondContact O-CB 3.48Å; L547-L551 PolarHBondContact O-N 3.12Å; E548-L551 PolarHBondContact O-N 3.02Å; I549-L551 VanDerWaalsContact C-N 3.34Å; I549-L551 PolarHBondContact O-N 3.26Å; L551-N554 PolarHBondContact O-N 2.85Å; L551-Y578 HydrophobicContact CD2-CD1 4.04Å; L551-Q581 HydrophobicContact CD2-CB 4.01Å; L551-Q581 HydrophobicContact CD2-CG 3.97Å; L551-A582 HydrophobicContact CD1-CB 4.02Å; L551-R587 HydrophobicContact CD1-CB 4.27Å; L551-R587 HydrophobicContact CD1-CG 3.95Å; L551-R587 PolarHBondContact O-NE 3.17Å; L551-R587 VanDerWaalsContact O-NE 3.11Å; L551-R587 PolarHBondContact O-NH2 2.9Å; L551-F590 HydrophobicContact CB-CE1 4.28Å; L551-F590 HydrophobicContact CB-CZ 4.42Å; L551-F590 HydrophobicContact CD1-CB 3.97Å; L551-F590 HydrophobicContact CD1-CD1 3.7Å; L551-F590 HydrophobicContact CD1-CD2 3.85Å; L551-F590 HydrophobicContact CD1-CE1 4.13Å; L551-F590 HydrophobicContact CD1-CE2 4.26Å; L551-F590 HydrophobicContact CD1-CG 3.56Å; L551-F590 HydrophobicContact CD1-CZ 4.4Å
552	T	73.8	Confident	76.7	Confident	47 Å²	47	41.4 Å²	41.4	29%	0.288	20%	0.198	S	C	.	.	H	α-helix	trans	-68.9	-38	175.7	50.3	0	0	0	0	111.7	E548 I549 N554 R587	E548-T552 WeakPolarHBondContact O-CB 3.3Å; E548-T552 VanDerWaalsContact O-CG2 3.29Å; E548-T552 WeakPolarHBondContact O-CG2 3.38Å; E548-T552 PolarHBondContact O-N 3.12Å; E548-T552 PolarHBondContact O-OG1 2.85Å; I549-T552 WeakPolarHBondContact CA-OG1 3.27Å; I549-T552 PolarHBondContact O-N 3.2Å; I549-T552 PolarHBondContact O-OG1 2.82Å; T552-N554 VanDerWaalsContact C-N 3.29Å; T552-N554 PolarHBondContact O-N 3.41Å; T552-R587 PolarHBondContact O-NH2 2.95Å
553	L	72.5	Confident	77.5	Confident	15 Å²	15	40 Å²	40	8%	0.079	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.6	174.8	-63.4	176	0	0	0	114.4	L102 I526 L529 I549 T550 R555	L102-L553 HydrophobicContact CB-CD2 4.22Å; L102-L553 HydrophobicContact CD2-CD2 4.18Å; I526-L553 HydrophobicContact CD1-CD1 4.21Å; I526-L553 HydrophobicContact CG1-CD1 4.01Å; I526-L553 HydrophobicContact CG2-CD1 4.15Å; L529-L553 HydrophobicContact CD1-CD1 4.5Å; I549-L553 HydrophobicContact CG2-CD1 3.72Å; I549-L553 HydrophobicContact CG2-CG 4.37Å; I549-L553 WeakPolarHBondContact O-CB 3.19Å; I549-L553 VanDerWaalsContact O-CG 3.23Å; I549-L553 WeakPolarHBondContact O-CG 3.27Å; I549-L553 PolarHBondContact O-N 2.74Å; T550-L553 PolarHBondContact O-N 2.98Å; L553-R555 VanDerWaalsContact C-N 3.35Å; L553-R555 HydrophobicContact CB-CG 4.34Å; L553-R555 PolarHBondContact O-N 2.74Å
554	N	77.5	Confident	77.9	Confident	72 Å²	72	38.4 Å²	38.4	39%	0.385	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	36.4	-176.3	-162.2	32.3	0	0	0	114.6	T550 L551 T552 R587	T550-N554 PolarHBondContact O-N 2.93Å; L551-N554 PolarHBondContact O-N 2.85Å; T552-N554 VanDerWaalsContact C-N 3.29Å; T552-N554 PolarHBondContact O-N 3.41Å; N554-R587 VanDerWaalsContact OD1-CD 3.3Å; N554-R587 WeakPolarHBondContact OD1-CD 3.39Å
555	R	79.1	Confident	77.9	Confident	47 Å²	47	41.7 Å²	41.7	18%	0.177	20%	0.199	C	C	.	.			trans	-111.9	80.6	-178.1	-66.3	-66	-67.4	-104.2	1.8	112.5	D522 I526 T550 L553 D557 I558 A559	D522-R555 IonicContact OD2-CZ 2.66Å; D522-R555 IonicContact OD2-NH1 3.52Å; D522-R555 PolarHBondContact OD2-NH1 2.94Å; D522-R555 IonicContact OD2-NH2 2.67Å; D522-R555 PolarHBondContact OD2-NH2 3.05Å; I526-R555 HydrophobicContact CD1-CB 4.49Å; I526-R555 HydrophobicContact CD1-CG 3.74Å; T550-R555 PolarHBondContact O-N 2.91Å; L553-R555 VanDerWaalsContact C-N 3.35Å; L553-R555 HydrophobicContact CB-CG 4.34Å; L553-R555 PolarHBondContact O-N 2.74Å; R555-D557 VanDerWaalsContact C-N 3.35Å; R555-D557 VanDerWaalsContact CA-OD1 3.28Å; R555-D557 WeakPolarHBondContact CA-OD1 3.37Å; R555-D557 WeakPolarHBondContact CB-OD1 3.29Å; R555-D557 IonicContact CZ-OD2 3.69Å; R555-D557 IonicContact NE-OD1 2.84Å; R555-D557 PolarHBondContact NE-OD1 3.02Å; R555-D557 VanDerWaalsContact NE-OD1 3.16Å; R555-D557 IonicContact NE-OD2 3.56Å; R555-D557 PolarHBondContact NE-OD2 3.14Å; R555-D557 VanDerWaalsContact NE-OD2 3.13Å; R555-D557 IonicContact NH2-OD2 3.8Å; R555-D557 PolarHBondContact NH2-OD2 3.44Å; R555-I558 HydrophobicContact CB-CB 4.31Å; R555-I558 HydrophobicContact CB-CD1 3.99Å; R555-I558 HydrophobicContact CB-CG1 4.22Å; R555-I558 HydrophobicContact CG-CD1 4.28Å; R555-A559 PolarHBondContact O-N 3.04Å
556	A	83.3	Confident	77.5	Confident	7 Å²	7	48.2 Å²	48.2	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-73	-27.3	-179.3	0	0	0	0	0	113.1	A559 R560 D589 F590	A556-A559 PolarHBondContact O-N 3.36Å; A556-R560 WeakPolarHBondContact O-CB 3.36Å; A556-R560 PolarHBondContact O-N 3.13Å; A556-D589 HydrophobicContact CB-CB 3.58Å; A556-F590 HydrophobicContact CB-CD2 3.75Å; A556-F590 HydrophobicContact CB-CE2 3.73Å; A556-F590 HydrophobicContact CB-CG 4.17Å; A556-F590 HydrophobicContact CB-CZ 4.11Å
557	D	81.5	Confident	76.9	Confident	63 Å²	63	54.7 Å²	54.7	34%	0.337	27%	0.266	S	S	.	.	H	α-helix	trans	-53.9	-55.4	169.1	55.2	-29.9	0	0	0	110.9	R555 A559 R560 E561	R555-D557 VanDerWaalsContact C-N 3.35Å; R555-D557 VanDerWaalsContact CA-OD1 3.28Å; R555-D557 WeakPolarHBondContact CA-OD1 3.37Å; R555-D557 WeakPolarHBondContact CB-OD1 3.29Å; R555-D557 IonicContact CZ-OD2 3.69Å; R555-D557 IonicContact NE-OD1 2.84Å; R555-D557 PolarHBondContact NE-OD1 3.02Å; R555-D557 VanDerWaalsContact NE-OD1 3.16Å; R555-D557 IonicContact NE-OD2 3.56Å; R555-D557 PolarHBondContact NE-OD2 3.14Å; R555-D557 VanDerWaalsContact NE-OD2 3.13Å; R555-D557 IonicContact NH2-OD2 3.8Å; R555-D557 PolarHBondContact NH2-OD2 3.44Å; D557-A559 VanDerWaalsContact C-N 3.35Å; D557-A559 PolarHBondContact O-N 2.96Å; D557-R560 WeakPolarHBondContact O-CB 3.36Å; D557-R560 PolarHBondContact O-N 2.81Å; D557-E561 PolarHBondContact O-N 2.96Å; D557-E561 VanDerWaalsContact O-N 3.11Å
558	I	79.1	Confident	76.3	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.046	28%	0.277	C	S	.	.	H	α-helix	trans	-66.9	-37.7	-179.1	-58.7	176.9	0	0	0	111	I526 L530 T550 R555 R560 E561 K562	I526-I558 HydrophobicContact CB-CD1 3.72Å; I526-I558 HydrophobicContact CD1-CD1 3.6Å; I526-I558 HydrophobicContact CG1-CD1 4.26Å; I526-I558 HydrophobicContact CG2-CD1 3.55Å; I526-I558 HydrophobicContact CG2-CG2 4.12Å; L530-I558 HydrophobicContact CD1-CG2 3.43Å; L530-I558 VanDerWaalsContact CD1-CG2 3.43Å; T550-I558 HydrophobicContact CG2-CG2 4.33Å; R555-I558 HydrophobicContact CB-CB 4.31Å; R555-I558 HydrophobicContact CB-CD1 3.99Å; R555-I558 HydrophobicContact CB-CG1 4.22Å; R555-I558 HydrophobicContact CG-CD1 4.28Å; I558-R560 VanDerWaalsContact C-N 3.33Å; I558-R560 PolarHBondContact O-N 2.75Å; I558-E561 PolarHBondContact O-N 2.67Å; I558-K562 HydrophobicContact CG2-CD 4.01Å; I558-K562 HydrophobicContact CG2-CG 4.28Å; I558-K562 WeakPolarHBondContact O-CB 3.31Å; I558-K562 PolarHBondContact O-N 3.24Å
559	A	82.2	Confident	75.9	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-41	175.4	0	0	0	0	0	112	T550 R555 A556 D557 I563 F564 F590 L593	T550-A559 HydrophobicContact CG2-CB 4.29Å; R555-A559 PolarHBondContact O-N 3.04Å; A556-A559 PolarHBondContact O-N 3.36Å; D557-A559 VanDerWaalsContact C-N 3.35Å; D557-A559 PolarHBondContact O-N 2.96Å; A559-I563 HydrophobicContact CB-CD1 4.2Å; A559-I563 WeakPolarHBondContact O-CA 3.45Å; A559-I563 WeakPolarHBondContact O-CB 3.33Å; A559-I563 PolarHBondContact O-N 3.34Å; A559-F564 WeakPolarHBondContact O-CD2 3.3Å; A559-F564 PolarHBondContact O-N 3.29Å; A559-F564 VanDerWaalsContact O-N 3.11Å; A559-F590 HydrophobicContact CB-CE1 3.8Å; A559-F590 HydrophobicContact CB-CZ 4.23Å; A559-L593 HydrophobicContact CB-CD2 3.92Å
560	R	83.6	Confident	75.8	Confident	110 Å²	110	66.1 Å²	66.1	42%	0.415	31%	0.312	S	S	.	.	H	α-helix	trans	-62.6	-46.9	176.8	-173.8	-174.8	-67.6	122.9	0.3	111.2	A556 D557 I558 L593	A556-R560 WeakPolarHBondContact O-CB 3.36Å; A556-R560 PolarHBondContact O-N 3.13Å; D557-R560 WeakPolarHBondContact O-CB 3.36Å; D557-R560 PolarHBondContact O-N 2.81Å; I558-R560 VanDerWaalsContact C-N 3.33Å; I558-R560 PolarHBondContact O-N 2.75Å; R560-L593 HydrophobicContact CB-CD1 3.92Å; R560-L593 HydrophobicContact CB-CD2 4.4Å; R560-L593 HydrophobicContact CG-CD1 3.96Å
561	E	78.9	Confident	75.2	Confident	141 Å²	141	71.9 Å²	71.9	66%	0.659	34%	0.337	S	S	*	.	H	α-helix	trans	-74.1	-37.4	-176.1	-68.9	177.7	-178.1	0	0	113.5	D557 I558 L565	D557-E561 PolarHBondContact O-N 2.96Å; D557-E561 VanDerWaalsContact O-N 3.11Å; I558-E561 PolarHBondContact O-N 2.67Å; E561-L565 VanDerWaalsContact O-CD2 3.29Å; E561-L565 WeakPolarHBondContact O-CD2 3.45Å
562	K	74.1	Confident	74.7	Confident	86 Å²	86	81.2 Å²	81.2	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-105.6	-32.3	-171.1	-61.5	-164.8	173.3	-161.6	0	115.5	S527 L530 I558	S527-K562 PolarHBondContact OG-NZ 3.49Å; L530-K562 HydrophobicContact CD1-CD 3.94Å; I558-K562 HydrophobicContact CG2-CD 4.01Å; I558-K562 HydrophobicContact CG2-CG 4.28Å; I558-K562 WeakPolarHBondContact O-CB 3.31Å; I558-K562 PolarHBondContact O-N 3.24Å
563	I	79.5	Confident	74.6	Confident	1 Å²	1	80.8 Å²	80.8	1%	0.005	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-39.5	-169.6	-56	176.9	0	0	0	111.7	Q546 L547 T550 A559 L565 K568 W570	Q546-I563 VanDerWaalsContact C-CD1 3.47Å; Q546-I563 HydrophobicContact CB-CD1 3.93Å; Q546-I563 HydrophobicContact CB-CG1 4.23Å; Q546-I563 WeakPolarHBondContact O-CD1 3.43Å; L547-I563 HydrophobicContact CB-CD1 4.29Å; L547-I563 HydrophobicContact CB-CG2 4.43Å; L547-I563 HydrophobicContact CD1-CD1 4.35Å; T550-I563 HydrophobicContact CG2-CD1 3.72Å; T550-I563 WeakPolarHBondContact OG1-CD1 3.23Å; A559-I563 HydrophobicContact CB-CD1 4.2Å; A559-I563 WeakPolarHBondContact O-CA 3.45Å; A559-I563 WeakPolarHBondContact O-CB 3.33Å; A559-I563 PolarHBondContact O-N 3.34Å; I563-L565 PolarHBondContact O-N 2.89Å; I563-K568 PolarHBondContact O-NZ 3.25Å; I563-W570 HydrophobicContact CG2-CH2 3.82Å; I563-W570 HydrophobicContact CG2-CZ2 3.88Å
564	F	79.6	Confident	75	Confident	9 Å²	9	82.8 Å²	82.8	4%	0.039	39%	0.392	C	S	.	.	S	Bend	trans	-98.2	51.9	-177.4	-69.5	-77.7	0	0	0	112.5	L547 A559 W570 L575 L593 F594 Q597	L547-F564 HydrophobicContact CD1-CE2 3.79Å; L547-F564 HydrophobicContact CD1-CZ 4.13Å; L547-F564 HydrophobicContact CD2-CZ 4.33Å; A559-F564 WeakPolarHBondContact O-CD2 3.3Å; A559-F564 PolarHBondContact O-N 3.29Å; A559-F564 VanDerWaalsContact O-N 3.11Å; F564-W570 AromaticContact CD1-CE2 3.83Å; F564-W570 AromaticContact CD1-CZ2 3.79Å; F564-W570 HydrophobicContact CD1-CZ2 3.79Å; F564-W570 AromaticContact CD1-NE1 3.47Å; F564-W570 HydrophobicContact CE1-CD2 4.47Å; F564-W570 AromaticContact CE1-CE2 3.56Å; F564-W570 HydrophobicContact CE1-CH2 4.41Å; F564-W570 AromaticContact CE1-CZ2 3.52Å; F564-W570 HydrophobicContact CE1-CZ2 3.52Å; F564-W570 AromaticContact CE1-NE1 3.54Å; F564-W570 HydrophobicContact CZ-CZ2 4.06Å; F564-L575 HydrophobicContact CE1-CD1 4.42Å; F564-L593 HydrophobicContact CD2-CD1 4.37Å; F564-L593 HydrophobicContact CD2-CD2 3.7Å; F564-L593 HydrophobicContact CD2-CG 4.05Å; F564-L593 HydrophobicContact CE2-CD2 3.78Å; F564-L593 HydrophobicContact CE2-CG 4.16Å; F564-F594 HydrophobicContact CE2-CD1 4.25Å; F564-F594 AromaticContact CE2-CE1 3.96Å; F564-F594 HydrophobicContact CE2-CE1 3.96Å; F564-F594 AromaticContact CZ-CD1 3.76Å; F564-F594 HydrophobicContact CZ-CD1 3.76Å; F564-F594 AromaticContact CZ-CE1 3.67Å; F564-F594 HydrophobicContact CZ-CE1 3.67Å; F564-Q597 HydrophobicContact CB-CG 4.26Å; F564-Q597 HydrophobicContact CD1-CB 4.19Å; F564-Q597 HydrophobicContact CD1-CG 3.56Å; F564-Q597 HydrophobicContact CE1-CB 4.35Å; F564-Q597 HydrophobicContact CE1-CG 4.07Å; F564-Q597 HydrophobicContact CG-CG 3.97Å
565	L	74	Confident	75.3	Confident	105 Å²	105	80 Å²	80	55%	0.55	38%	0.377	S	S	.	.			trans	-66.1	140.9	173.5	-60.7	172.9	0	0	0	111.2	E561 I563 N567 K568	E561-L565 VanDerWaalsContact O-CD2 3.29Å; E561-L565 WeakPolarHBondContact O-CD2 3.45Å; I563-L565 PolarHBondContact O-N 2.89Å; L565-N567 PolarHBondContact O-N 2.95Å; L565-K568 PolarHBondContact O-N 3.5Å; L565-K568 VanDerWaalsContact O-N 3.09Å
566	E	61.2	Low	75.7	Confident	197 Å²	197	80 Å²	80	92%	0.921	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-24.9	-171.8	-66	-174.4	164.7	0	0	114.9
567	N	62.9	Low	75.8	Confident	165 Å²	165	85.7 Å²	85.7	88%	0.882	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-2.6	-175.8	-67.7	-37	0	0	0	114.8	L565	L565-N567 PolarHBondContact O-N 2.95Å
568	K	67.7	Low	76	Confident	56 Å²	56	84.1 Å²	84.1	24%	0.243	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-99.6	128.7	-171.3	-175	170.9	159.7	-161.5	0	113	N543 I563 L565 W570	N543-K568 WeakPolarHBondContact OD1-CE 3.36Å; N543-K568 PolarHBondContact OD1-NZ 2.83Å; I563-K568 PolarHBondContact O-NZ 3.25Å; L565-K568 PolarHBondContact O-N 3.5Å; L565-K568 VanDerWaalsContact O-N 3.09Å; K568-W570 HydrophobicContact CD-CZ2 4.25Å; K568-W570 VanDerWaalsContact CE-CZ2 3.41Å; K568-W570 VanDerWaalsContact NZ-CH2 3.32Å
569	K	66.7	Low	76.5	Confident	204 Å²	204	83.7 Å²	83.7	89%	0.887	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-103.7	122.9	177	-66.2	-177.6	-179.3	177	0	111.4
570	W	74.3	Confident	76.9	Confident	52 Å²	52	85.7 Å²	85.7	20%	0.197	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-90	140.8	176.3	-59.4	89.1	0	0	0	111.5	N543 L544 L547 I563 F564 K568 L575	N543-W570 HydrophobicContact CB-CH2 4.3Å; L544-W570 HydrophobicContact CD2-CZ3 4.07Å; L547-W570 HydrophobicContact CD2-CH2 4.46Å; I563-W570 HydrophobicContact CG2-CH2 3.82Å; I563-W570 HydrophobicContact CG2-CZ2 3.88Å; F564-W570 AromaticContact CD1-CE2 3.83Å; F564-W570 AromaticContact CD1-CZ2 3.79Å; F564-W570 HydrophobicContact CD1-CZ2 3.79Å; F564-W570 AromaticContact CD1-NE1 3.47Å; F564-W570 HydrophobicContact CE1-CD2 4.47Å; F564-W570 AromaticContact CE1-CE2 3.56Å; F564-W570 HydrophobicContact CE1-CH2 4.41Å; F564-W570 AromaticContact CE1-CZ2 3.52Å; F564-W570 HydrophobicContact CE1-CZ2 3.52Å; F564-W570 AromaticContact CE1-NE1 3.54Å; F564-W570 HydrophobicContact CZ-CZ2 4.06Å; K568-W570 HydrophobicContact CD-CZ2 4.25Å; K568-W570 VanDerWaalsContact CE-CZ2 3.41Å; K568-W570 VanDerWaalsContact NZ-CH2 3.32Å; W570-L575 HydrophobicContact CB-CD1 4.4Å; W570-L575 HydrophobicContact CD2-CD1 4.39Å; W570-L575 HydrophobicContact CD2-CD2 4.28Å; W570-L575 HydrophobicContact CE3-CD2 3.86Å; W570-L575 HydrophobicContact CE3-CG 4.33Å; W570-L575 HydrophobicContact CG-CD1 4.27Å; W570-L575 HydrophobicContact CH2-CD2 4.48Å; W570-L575 HydrophobicContact CZ3-CD2 3.98Å
571	K	68.6	Low	77	Confident	121 Å²	121	83.7 Å²	83.7	53%	0.526	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-74.6	144.1	176	-51.7	174.1	-170	153.8	0	109.3	D540 G573 Q574	D540-K571 IonicContact OD2-NZ 2.96Å; D540-K571 PolarHBondContact OD2-NZ 2.61Å; K571-G573 PolarHBondContact O-N 3.46Å; K571-Q574 VanDerWaalsContact CB-CD 3.48Å; K571-Q574 HydrophobicContact CB-CG 3.86Å; K571-Q574 VanDerWaalsContact CB-OE1 3.31Å; K571-Q574 PolarHBondContact O-N 3.37Å
572	K	68.4	Low	77.5	Confident	198 Å²	198	77 Å²	77	86%	0.861	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	126.9	176.7	-67.2	-168.7	175.6	-163.9	0	110.4
573	G	72.8	Confident	78.3	Confident	39 Å²	39	72.9 Å²	72.9	40%	0.402	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	-14.4	179.2	0	0	0	0	0	116.1	K571 L575 N576	K571-G573 PolarHBondContact O-N 3.46Å; G573-L575 VanDerWaalsContact C-N 3.26Å; G573-L575 PolarHBondContact O-N 2.95Å; G573-N576 WeakPolarHBondContact O-CB 3.28Å; G573-N576 PolarHBondContact O-N 3.43Å
574	Q	79.7	Confident	78.6	Confident	57 Å²	57	74.5 Å²	74.5	27%	0.266	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-29.5	-179.9	-79.8	-178.3	-39.1	0	0	113.8	K571	K571-Q574 VanDerWaalsContact CB-CD 3.48Å; K571-Q574 HydrophobicContact CB-CG 3.86Å; K571-Q574 VanDerWaalsContact CB-OE1 3.31Å; K571-Q574 PolarHBondContact O-N 3.37Å
575	L	84.8	Confident	78.6	Confident	14 Å²	14	77.1 Å²	77.1	7%	0.073	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-1.1	-178.8	-64.3	174.7	0	0	0	113.2	L547 F564 W570 G573 D577 Y578 M579 F599	L547-L575 HydrophobicContact CD2-CD2 3.61Å; F564-L575 HydrophobicContact CE1-CD1 4.42Å; W570-L575 HydrophobicContact CB-CD1 4.4Å; W570-L575 HydrophobicContact CD2-CD1 4.39Å; W570-L575 HydrophobicContact CD2-CD2 4.28Å; W570-L575 HydrophobicContact CE3-CD2 3.86Å; W570-L575 HydrophobicContact CE3-CG 4.33Å; W570-L575 HydrophobicContact CG-CD1 4.27Å; W570-L575 HydrophobicContact CH2-CD2 4.48Å; W570-L575 HydrophobicContact CZ3-CD2 3.98Å; G573-L575 VanDerWaalsContact C-N 3.26Å; G573-L575 PolarHBondContact O-N 2.95Å; L575-D577 PolarHBondContact O-N 2.79Å; L575-Y578 PolarHBondContact O-N 3.38Å; L575-M579 WeakPolarHBondContact O-CB 3.29Å; L575-M579 PolarHBondContact O-N 3.15Å; L575-F599 HydrophobicContact CB-CD2 3.76Å; L575-F599 HydrophobicContact CB-CE2 3.78Å; L575-F599 HydrophobicContact CD1-CD2 4.41Å
576	N	86.4	Confident	79.1	Confident	47 Å²	47	74.4 Å²	74.4	25%	0.251	37%	0.365	S	S	.	.	H	α-helix	trans	-64.1	-41.6	-172.1	-74.6	0.6	0	0	0	112.6	G573 M579 Y580 F599 F604	G573-N576 WeakPolarHBondContact O-CB 3.28Å; G573-N576 PolarHBondContact O-N 3.43Å; N576-M579 PolarHBondContact O-N 3.11Å; N576-Y580 PolarHBondContact O-N 2.89Å; N576-F599 VanDerWaalsContact OD1-CE2 3.29Å; N576-F599 WeakPolarHBondContact OD1-CE2 3.48Å; N576-F599 VanDerWaalsContact OD1-CZ 3.26Å; N576-F599 WeakPolarHBondContact OD1-CZ 3.4Å; N576-F604 HydrophobicContact CB-CD2 4.01Å; N576-F604 HydrophobicContact CB-CE2 4.36Å; N576-F604 VanDerWaalsContact O-CE2 3.26Å; N576-F604 WeakPolarHBondContact O-CE2 3.38Å
577	D	85	Confident	80.4	Confident	126 Å²	126	67.5 Å²	67.5	67%	0.674	33%	0.33	S	S	*	.	H	α-helix	trans	-69.1	-40.8	-178.9	-63.9	-31.8	0	0	0	111.1	L575 Y580 Q581	L575-D577 PolarHBondContact O-N 2.79Å; D577-Y580 PolarHBondContact O-N 3.06Å; D577-Q581 PolarHBondContact O-N 3.04Å
578	Y	87.1	Confident	81.6	Confident	30 Å²	30	62.6 Å²	62.6	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-39	173.2	-58.8	-78.4	0	0	0	112.5	L544 L547 E548 L551 L575 Q581 A582	L544-Y578 WeakPolarHBondContact CB-OH 3.35Å; L544-Y578 HydrophobicContact CD2-CE2 3.75Å; L544-Y578 PolarHBondContact O-OH 3.15Å; L547-Y578 HydrophobicContact CD2-CD1 4.21Å; L547-Y578 HydrophobicContact CD2-CD2 4.07Å; L547-Y578 HydrophobicContact CD2-CE2 4.48Å; L547-Y578 HydrophobicContact CD2-CG 3.92Å; L547-Y578 HydrophobicContact CG-CD1 4.2Å; L547-Y578 HydrophobicContact CG-CE1 4.5Å; L547-Y578 HydrophobicContact CG-CG 4.4Å; E548-Y578 HydrophobicContact CB-CE1 3.91Å; E548-Y578 HydrophobicContact CG-CE1 4.35Å; L551-Y578 HydrophobicContact CD2-CD1 4.04Å; L575-Y578 PolarHBondContact O-N 3.38Å; Y578-Q581 PolarHBondContact O-N 2.71Å; Y578-A582 VanDerWaalsContact O-CB 3.24Å; Y578-A582 WeakPolarHBondContact O-CB 3.43Å; Y578-A582 PolarHBondContact O-N 3.46Å
579	M	89.2	Confident	82.6	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.7	-43.5	173.2	178.2	61.7	81.3	0	0	111	L575 N576 A582 L583 V591 F594 F599 F604	L575-M579 WeakPolarHBondContact O-CB 3.29Å; L575-M579 PolarHBondContact O-N 3.15Å; N576-M579 PolarHBondContact O-N 3.11Å; M579-A582 PolarHBondContact O-N 3.19Å; M579-L583 HydrophobicContact CG-CD1 4.2Å; M579-L583 WeakPolarHBondContact O-CB 3.35Å; M579-L583 VanDerWaalsContact O-CG 3.27Å; M579-L583 WeakPolarHBondContact O-CG 3.5Å; M579-L583 PolarHBondContact O-N 3.44Å; M579-L583 HydrophobicContact SD-CD1 4.36Å; M579-L583 HydrophobicContact SD-CG 4.25Å; M579-V591 HydrophobicContact CE-CG1 4.49Å; M579-V591 HydrophobicContact SD-CB 4.5Å; M579-V591 HydrophobicContact SD-CG1 4.09Å; M579-V591 HydrophobicContact SD-CG2 4.1Å; M579-F594 HydrophobicContact CB-CD2 4.39Å; M579-F594 HydrophobicContact CE-CB 3.49Å; M579-F594 VanDerWaalsContact CE-CB 3.49Å; M579-F594 HydrophobicContact CE-CD2 3.81Å; M579-F594 HydrophobicContact CE-CG 4.15Å; M579-F594 HydrophobicContact SD-CD2 4.11Å; M579-F599 HydrophobicContact CB-CE1 4.14Å; M579-F599 HydrophobicContact CB-CE2 4.04Å; M579-F599 HydrophobicContact CB-CZ 3.67Å; M579-F599 HydrophobicContact CE-CB 4.29Å; M579-F599 HydrophobicContact CE-CD1 3.42Å; M579-F599 VanDerWaalsContact CE-CD1 3.42Å; M579-F599 HydrophobicContact CE-CD2 4.37Å; M579-F599 HydrophobicContact CE-CE1 3.71Å; M579-F599 HydrophobicContact CE-CG 3.78Å; M579-F599 HydrophobicContact CE-CZ 4.31Å; M579-F599 HydrophobicContact CG-CD1 4.41Å; M579-F599 HydrophobicContact CG-CE1 3.71Å; M579-F599 HydrophobicContact CG-CZ 3.76Å; M579-F604 HydrophobicContact CB-CE2 4.2Å; M579-F604 HydrophobicContact CB-CZ 4.29Å; M579-F604 HydrophobicContact CG-CD1 4.17Å; M579-F604 HydrophobicContact CG-CD2 4.43Å; M579-F604 HydrophobicContact CG-CE1 3.85Å; M579-F604 HydrophobicContact CG-CE2 4.13Å; M579-F604 HydrophobicContact CG-CG 4.44Å; M579-F604 HydrophobicContact CG-CZ 3.83Å
580	Y	90.5	Very high	83.7	Confident	41 Å²	41	53.3 Å²	53.3	16%	0.161	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-45.4	175.4	171.2	-91.6	0	0	0	111.7	N576 D577 L583 M584 M609 K612 L613 D616	N576-Y580 PolarHBondContact O-N 2.89Å; D577-Y580 PolarHBondContact O-N 3.06Å; Y580-L583 PolarHBondContact O-N 3.42Å; Y580-M584 HydrophobicContact CD1-CG 4.37Å; Y580-M584 HydrophobicContact CD2-CG 4.48Å; Y580-M584 HydrophobicContact CE1-CG 3.95Å; Y580-M584 HydrophobicContact CE2-CG 4.1Å; Y580-M584 HydrophobicContact CE2-SD 4.42Å; Y580-M584 VanDerWaalsContact O-CG 3.3Å; Y580-M584 WeakPolarHBondContact O-CG 3.3Å; Y580-M584 PolarHBondContact O-N 3.33Å; Y580-M609 HydrophobicContact CD2-CE 3.63Å; Y580-M609 HydrophobicContact CE2-CE 4.45Å; Y580-M609 HydrophobicContact CG-CE 4.21Å; Y580-K612 HydrophobicContact CE2-CD 4Å; Y580-K612 HydrophobicContact CE2-CG 4.08Å; Y580-L613 HydrophobicContact CD2-CD2 3.78Å; Y580-L613 HydrophobicContact CD2-CG 4.42Å; Y580-L613 HydrophobicContact CE2-CD2 3.83Å; Y580-L613 HydrophobicContact CE2-CG 4.4Å; Y580-D616 PolarHBondContact OH-OD2 2.74Å
581	Q	86.6	Confident	84.5	Confident	68 Å²	68	50.8 Å²	50.8	32%	0.318	26%	0.255	S	S	.	.	H	α-helix	trans	-64.8	-41.1	177.1	-172.9	178.8	11.9	0	0	112.1	L551 D577 Y578 M584 S585	L551-Q581 HydrophobicContact CD2-CB 4.01Å; L551-Q581 HydrophobicContact CD2-CG 3.97Å; D577-Q581 PolarHBondContact O-N 3.04Å; Y578-Q581 PolarHBondContact O-N 2.71Å; Q581-M584 PolarHBondContact O-N 3.13Å; Q581-S585 WeakPolarHBondContact O-CB 3.23Å; Q581-S585 PolarHBondContact O-N 3.09Å; Q581-S585 PolarHBondContact O-OG 2.85Å
582	A	89.2	Confident	85.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.6	-42.9	175.6	0	0	0	0	0	112.1	L551 Y578 M579 D586 R587 F590 V591 F594	L551-A582 HydrophobicContact CD1-CB 4.02Å; Y578-A582 VanDerWaalsContact O-CB 3.24Å; Y578-A582 WeakPolarHBondContact O-CB 3.43Å; Y578-A582 PolarHBondContact O-N 3.46Å; M579-A582 PolarHBondContact O-N 3.19Å; A582-D586 PolarHBondContact O-N 2.86Å; A582-D586 VanDerWaalsContact O-N 3.09Å; A582-R587 HydrophobicContact CB-CB 4.09Å; A582-R587 HydrophobicContact CB-CG 4.47Å; A582-R587 PolarHBondContact O-N 2.88Å; A582-F590 HydrophobicContact CB-CB 4.23Å; A582-V591 HydrophobicContact CB-CG2 3.84Å; A582-F594 HydrophobicContact CB-CE2 4.03Å
583	L	89.7	Confident	86.5	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.6	-41.4	174	-70.6	170.9	0	0	0	111.6	M579 Y580 V591 F604 L613 L1165 W1168 K1174 F1181	M579-L583 HydrophobicContact CG-CD1 4.2Å; M579-L583 WeakPolarHBondContact O-CB 3.35Å; M579-L583 VanDerWaalsContact O-CG 3.27Å; M579-L583 WeakPolarHBondContact O-CG 3.5Å; M579-L583 PolarHBondContact O-N 3.44Å; M579-L583 HydrophobicContact SD-CD1 4.36Å; M579-L583 HydrophobicContact SD-CG 4.25Å; Y580-L583 PolarHBondContact O-N 3.42Å; L583-V591 HydrophobicContact CD2-CG1 4.37Å; L583-V591 HydrophobicContact CD2-CG2 4.01Å; L583-V591 HydrophobicContact CG-CG2 4.36Å; L583-F604 HydrophobicContact CD1-CE1 3.59Å; L583-F604 HydrophobicContact CD1-CZ 3.96Å; L583-L613 HydrophobicContact CB-CD2 4.37Å; L583-L613 HydrophobicContact CD1-CD1 4.42Å; L583-L1165 HydrophobicContact CD1-CD2 4.34Å; L583-W1168 HydrophobicContact CB-CH2 4.1Å; L583-W1168 HydrophobicContact CD2-CZ3 4.23Å; L583-W1168 WeakPolarHBondContact O-CH2 3.29Å; L583-K1174 PolarHBondContact O-NZ 2.97Å; L583-F1181 HydrophobicContact CD2-CE2 4.2Å; L583-F1181 HydrophobicContact CD2-CZ 3.76Å
584	M	86.2	Confident	87.3	Confident	34 Å²	34	38.3 Å²	38.3	17%	0.167	19%	0.19	C	C	.	.	H	α-helix	trans	-66	-45.6	-179.4	-73	-60.3	-63.2	0	0	112.2	Y580 Q581 D586 L613 D616 Q617 K1174	Y580-M584 HydrophobicContact CD1-CG 4.37Å; Y580-M584 HydrophobicContact CD2-CG 4.48Å; Y580-M584 HydrophobicContact CE1-CG 3.95Å; Y580-M584 HydrophobicContact CE2-CG 4.1Å; Y580-M584 HydrophobicContact CE2-SD 4.42Å; Y580-M584 VanDerWaalsContact O-CG 3.3Å; Y580-M584 WeakPolarHBondContact O-CG 3.3Å; Y580-M584 PolarHBondContact O-N 3.33Å; Q581-M584 PolarHBondContact O-N 3.13Å; M584-D586 VanDerWaalsContact C-N 3.33Å; M584-D586 PolarHBondContact O-N 2.93Å; M584-L613 HydrophobicContact CG-CD2 4.36Å; M584-L613 HydrophobicContact SD-CD2 3.89Å; M584-D616 HydrophobicContact CE-CB 3.6Å; M584-D616 HydrophobicContact SD-CB 4.32Å; M584-Q617 HydrophobicContact CE-CG 3.97Å; M584-Q617 PolarHBondContact O-NE2 3.49Å; M584-Q617 VanDerWaalsContact O-NE2 3.15Å; M584-Q617 HydrophobicContact SD-CG 3.92Å; M584-Q617 PolarHBondContact SD-NE2 2.83Å; M584-K1174 PolarHBondContact O-NZ 3.15Å
585	S	80.1	Confident	87.7	Confident	65 Å²	65	37.2 Å²	37.2	46%	0.455	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	2.8	-178.4	-56.9	0	0	0	0	114.9	Q581 R587	Q581-S585 WeakPolarHBondContact O-CB 3.23Å; Q581-S585 PolarHBondContact O-N 3.09Å; Q581-S585 PolarHBondContact O-OG 2.85Å; S585-R587 PolarHBondContact O-N 2.91Å
586	D	84.5	Confident	87.7	Confident	47 Å²	47	41.7 Å²	41.7	25%	0.251	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	38.5	-177	-126.4	54.2	0	0	0	116.5	A582 M584 H588 K1174 M1177	A582-D586 PolarHBondContact O-N 2.86Å; A582-D586 VanDerWaalsContact O-N 3.09Å; M584-D586 VanDerWaalsContact C-N 3.33Å; M584-D586 PolarHBondContact O-N 2.93Å; D586-H588 PolarHBondContact O-N 3.4Å; D586-K1174 WeakPolarHBondContact OD1-CD 3.3Å; D586-K1174 WeakPolarHBondContact OD1-CE 3.46Å; D586-K1174 WeakPolarHBondContact OD1-CG 3.35Å; D586-K1174 IonicContact OD1-NZ 2.72Å; D586-K1174 PolarHBondContact OD1-NZ 3.48Å; D586-M1177 WeakPolarHBondContact OD1-CG 3.43Å
587	R	87.1	Confident	87.5	Confident	53 Å²	53	43.4 Å²	43.4	20%	0.2	21%	0.213	C	C	.	.			trans	-74.5	68.9	176.5	-48.1	-56.6	-136.3	-161.3	2.1	110.9	L551 T552 N554 A582 S585 D589 F590 V591	L551-R587 HydrophobicContact CD1-CB 4.27Å; L551-R587 HydrophobicContact CD1-CG 3.95Å; L551-R587 PolarHBondContact O-NE 3.17Å; L551-R587 VanDerWaalsContact O-NE 3.11Å; L551-R587 PolarHBondContact O-NH2 2.9Å; T552-R587 PolarHBondContact O-NH2 2.95Å; N554-R587 VanDerWaalsContact OD1-CD 3.3Å; N554-R587 WeakPolarHBondContact OD1-CD 3.39Å; A582-R587 HydrophobicContact CB-CB 4.09Å; A582-R587 HydrophobicContact CB-CG 4.47Å; A582-R587 PolarHBondContact O-N 2.88Å; S585-R587 PolarHBondContact O-N 2.91Å; R587-D589 VanDerWaalsContact C-N 3.26Å; R587-D589 PolarHBondContact O-N 2.69Å; R587-F590 HydrophobicContact CB-CB 3.87Å; R587-F590 HydrophobicContact CB-CD2 3.93Å; R587-F590 HydrophobicContact CB-CG 4.29Å; R587-F590 WeakPolarHBondContact O-CB 3.4Å; R587-F590 PolarHBondContact O-N 2.97Å; R587-V591 PolarHBondContact O-N 2.81Å
588	H	89.3	Confident	87.1	Confident	61 Å²	61	40.4 Å²	40.4	28%	0.282	21%	0.211	S	C	.	.	H	α-helix	trans	-55.9	-37.4	-172	80.6	-58.4	0	0	0	113.6	D586 V591 K592 M1177	D586-H588 PolarHBondContact O-N 3.4Å; H588-V591 PolarHBondContact O-N 2.88Å; H588-K592 WeakPolarHBondContact O-CB 3.3Å; H588-K592 PolarHBondContact O-N 3Å; H588-M1177 VanDerWaalsContact CA-CE 3.41Å; H588-M1177 HydrophobicContact CB-CE 3.97Å; H588-M1177 HydrophobicContact CB-SD 3.91Å
589	D	87.9	Confident	87	Confident	65 Å²	65	40.2 Å²	40.2	35%	0.348	21%	0.211	S	C	.	.	H	α-helix	trans	-66.6	-37.7	175.9	-61.1	-54.9	0	0	0	112.8	A556 R587 L593	A556-D589 HydrophobicContact CB-CB 3.58Å; R587-D589 VanDerWaalsContact C-N 3.26Å; R587-D589 PolarHBondContact O-N 2.69Å; D589-L593 VanDerWaalsContact O-CB 3.29Å; D589-L593 WeakPolarHBondContact O-CB 3.36Å; D589-L593 PolarHBondContact O-N 2.94Å
590	F	90.5	Very high	86.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-68.9	-40.9	174	-83.8	-87	0	0	0	112	L547 T550 L551 A556 A559 A582 R587 K592 L593 F594	L547-F590 HydrophobicContact CD1-CE1 4.33Å; T550-F590 VanDerWaalsContact C-CZ 3.45Å; T550-F590 VanDerWaalsContact O-CZ 3.23Å; T550-F590 WeakPolarHBondContact O-CZ 3.46Å; L551-F590 HydrophobicContact CB-CE1 4.28Å; L551-F590 HydrophobicContact CB-CZ 4.42Å; L551-F590 HydrophobicContact CD1-CB 3.97Å; L551-F590 HydrophobicContact CD1-CD1 3.7Å; L551-F590 HydrophobicContact CD1-CD2 3.85Å; L551-F590 HydrophobicContact CD1-CE1 4.13Å; L551-F590 HydrophobicContact CD1-CE2 4.26Å; L551-F590 HydrophobicContact CD1-CG 3.56Å; L551-F590 HydrophobicContact CD1-CZ 4.4Å; A556-F590 HydrophobicContact CB-CD2 3.75Å; A556-F590 HydrophobicContact CB-CE2 3.73Å; A556-F590 HydrophobicContact CB-CG 4.17Å; A556-F590 HydrophobicContact CB-CZ 4.11Å; A559-F590 HydrophobicContact CB-CE1 3.8Å; A559-F590 HydrophobicContact CB-CZ 4.23Å; A582-F590 HydrophobicContact CB-CB 4.23Å; R587-F590 HydrophobicContact CB-CB 3.87Å; R587-F590 HydrophobicContact CB-CD2 3.93Å; R587-F590 HydrophobicContact CB-CG 4.29Å; R587-F590 WeakPolarHBondContact O-CB 3.4Å; R587-F590 PolarHBondContact O-N 2.97Å; F590-K592 VanDerWaalsContact C-N 3.33Å; F590-K592 PolarHBondContact O-N 3.43Å; F590-L593 PolarHBondContact O-N 2.77Å; F590-F594 HydrophobicContact CB-CE2 4.29Å; F590-F594 HydrophobicContact CB-CZ 4.32Å; F590-F594 HydrophobicContact CD1-CE1 4.18Å; F590-F594 AromaticContact CD1-CZ 3.91Å; F590-F594 HydrophobicContact CD1-CZ 3.91Å; F590-F594 WeakPolarHBondContact O-CB 3.45Å; F590-F594 WeakPolarHBondContact O-CD2 3.32Å; F590-F594 WeakPolarHBondContact O-CG 3.32Å; F590-F594 PolarHBondContact O-N 2.83Å
591	V	91.2	Very high	86.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-43.3	176.2	176.8	0	0	0	0	110.1	M579 A582 L583 R587 H588 F594 L595 M1177 L1180 F1181	M579-V591 HydrophobicContact CE-CG1 4.49Å; M579-V591 HydrophobicContact SD-CB 4.5Å; M579-V591 HydrophobicContact SD-CG1 4.09Å; M579-V591 HydrophobicContact SD-CG2 4.1Å; A582-V591 HydrophobicContact CB-CG2 3.84Å; L583-V591 HydrophobicContact CD2-CG1 4.37Å; L583-V591 HydrophobicContact CD2-CG2 4.01Å; L583-V591 HydrophobicContact CG-CG2 4.36Å; R587-V591 PolarHBondContact O-N 2.81Å; H588-V591 PolarHBondContact O-N 2.88Å; V591-F594 PolarHBondContact O-N 3.03Å; V591-L595 HydrophobicContact CG1-CD1 3.89Å; V591-L595 WeakPolarHBondContact O-CD1 3.24Å; V591-L595 WeakPolarHBondContact O-CG 3.45Å; V591-L595 PolarHBondContact O-N 3.29Å; V591-M1177 HydrophobicContact CB-CE 4.08Å; V591-M1177 HydrophobicContact CB-SD 4.19Å; V591-M1177 HydrophobicContact CG1-SD 4.4Å; V591-M1177 HydrophobicContact CG2-CE 3.51Å; V591-M1177 HydrophobicContact CG2-SD 4.17Å; V591-L1180 HydrophobicContact CB-CD2 4.2Å; V591-L1180 HydrophobicContact CG1-CD2 3.79Å; V591-F1181 HydrophobicContact CG1-CZ 4.16Å
592	K	90	Very high	86.4	Confident	96 Å²	96	42.7 Å²	42.7	42%	0.417	23%	0.23	S	C	.	.	H	α-helix	trans	-60	-47.3	173.2	-175	179.1	174.2	-173.7	0	111.5	H588 F590 F594 L595 E596 L1180	H588-K592 WeakPolarHBondContact O-CB 3.3Å; H588-K592 PolarHBondContact O-N 3Å; F590-K592 VanDerWaalsContact C-N 3.33Å; F590-K592 PolarHBondContact O-N 3.43Å; K592-F594 PolarHBondContact O-N 3.06Å; K592-L595 PolarHBondContact O-N 3.48Å; K592-E596 WeakPolarHBondContact CE-OE1 3.33Å; K592-E596 WeakPolarHBondContact O-CG 3.29Å; K592-E596 PolarHBondContact O-N 3.04Å; K592-L1180 HydrophobicContact CB-CD1 4.31Å; K592-L1180 HydrophobicContact CB-CD2 4.23Å; K592-L1180 HydrophobicContact CG-CD1 4.28Å
593	L	88.9	Confident	86	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-46.4	177	-180	62.5	0	0	0	111.9	A559 R560 F564 D589 F590 L595 E596 Q597	A559-L593 HydrophobicContact CB-CD2 3.92Å; R560-L593 HydrophobicContact CB-CD1 3.92Å; R560-L593 HydrophobicContact CB-CD2 4.4Å; R560-L593 HydrophobicContact CG-CD1 3.96Å; F564-L593 HydrophobicContact CD2-CD1 4.37Å; F564-L593 HydrophobicContact CD2-CD2 3.7Å; F564-L593 HydrophobicContact CD2-CG 4.05Å; F564-L593 HydrophobicContact CE2-CD2 3.78Å; F564-L593 HydrophobicContact CE2-CG 4.16Å; D589-L593 VanDerWaalsContact O-CB 3.29Å; D589-L593 WeakPolarHBondContact O-CB 3.36Å; D589-L593 PolarHBondContact O-N 2.94Å; F590-L593 PolarHBondContact O-N 2.77Å; L593-L595 VanDerWaalsContact C-N 3.33Å; L593-L595 PolarHBondContact O-N 3.3Å; L593-E596 PolarHBondContact O-N 3.25Å; L593-Q597 HydrophobicContact CD1-CG 4.35Å; L593-Q597 WeakPolarHBondContact O-CG 3.18Å; L593-Q597 PolarHBondContact O-N 3Å
594	F	89.7	Confident	85.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-38.2	178.2	-62.7	-22.8	0	0	0	112.4	L547 F564 M579 A582 F590 V591 K592 Q597 G598 F599	L547-F594 HydrophobicContact CD1-CE1 4.04Å; L547-F594 HydrophobicContact CD1-CZ 4.31Å; L547-F594 HydrophobicContact CD2-CE1 4.28Å; L547-F594 HydrophobicContact CD2-CZ 4.42Å; F564-F594 HydrophobicContact CE2-CD1 4.25Å; F564-F594 AromaticContact CE2-CE1 3.96Å; F564-F594 HydrophobicContact CE2-CE1 3.96Å; F564-F594 AromaticContact CZ-CD1 3.76Å; F564-F594 HydrophobicContact CZ-CD1 3.76Å; F564-F594 AromaticContact CZ-CE1 3.67Å; F564-F594 HydrophobicContact CZ-CE1 3.67Å; M579-F594 HydrophobicContact CB-CD2 4.39Å; M579-F594 HydrophobicContact CE-CB 3.49Å; M579-F594 VanDerWaalsContact CE-CB 3.49Å; M579-F594 HydrophobicContact CE-CD2 3.81Å; M579-F594 HydrophobicContact CE-CG 4.15Å; M579-F594 HydrophobicContact SD-CD2 4.11Å; A582-F594 HydrophobicContact CB-CE2 4.03Å; F590-F594 HydrophobicContact CB-CE2 4.29Å; F590-F594 HydrophobicContact CB-CZ 4.32Å; F590-F594 HydrophobicContact CD1-CE1 4.18Å; F590-F594 AromaticContact CD1-CZ 3.91Å; F590-F594 HydrophobicContact CD1-CZ 3.91Å; F590-F594 WeakPolarHBondContact O-CB 3.45Å; F590-F594 WeakPolarHBondContact O-CD2 3.32Å; F590-F594 WeakPolarHBondContact O-CG 3.32Å; F590-F594 PolarHBondContact O-N 2.83Å; V591-F594 PolarHBondContact O-N 3.03Å; K592-F594 PolarHBondContact O-N 3.06Å; F594-Q597 PolarHBondContact O-N 3.08Å; F594-G598 PolarHBondContact O-N 3.06Å; F594-F599 HydrophobicContact CB-CB 4.25Å; F594-F599 WeakPolarHBondContact O-CB 3.46Å; F594-F599 PolarHBondContact O-N 2.93Å
595	L	87.1	Confident	85.9	Confident	34 Å²	34	45.1 Å²	45.1	18%	0.178	24%	0.243	C	C	.	.	H	α-helix	trans	-68.9	-40.5	176.7	-67.2	165.8	0	0	0	112	V591 K592 L593 Q597 G598 L601 L1180 M1184	V591-L595 HydrophobicContact CG1-CD1 3.89Å; V591-L595 WeakPolarHBondContact O-CD1 3.24Å; V591-L595 WeakPolarHBondContact O-CG 3.45Å; V591-L595 PolarHBondContact O-N 3.29Å; K592-L595 PolarHBondContact O-N 3.48Å; L593-L595 VanDerWaalsContact C-N 3.33Å; L593-L595 PolarHBondContact O-N 3.3Å; L595-Q597 VanDerWaalsContact C-N 3.27Å; L595-Q597 PolarHBondContact O-N 3.41Å; L595-G598 PolarHBondContact O-N 2.84Å; L595-G598 VanDerWaalsContact O-N 3.11Å; L595-L601 HydrophobicContact CD2-CD1 3.73Å; L595-L601 HydrophobicContact CD2-CD2 3.95Å; L595-L601 HydrophobicContact CD2-CG 3.63Å; L595-L1180 HydrophobicContact CD1-CD2 4.09Å; L595-L1180 HydrophobicContact CD1-CG 4.36Å; L595-M1184 HydrophobicContact CD1-CE 3.39Å; L595-M1184 HydrophobicContact CD1-SD 3.67Å; L595-M1184 HydrophobicContact CD2-CE 4.41Å; L595-M1184 HydrophobicContact CD2-SD 3.92Å; L595-M1184 HydrophobicContact CG-SD 4.29Å
596	E	84.7	Confident	86.2	Confident	107 Å²	107	42.7 Å²	42.7	50%	0.5	23%	0.226	S	C	.	.	H	α-helix	trans	-60.6	-36	173.6	-74.3	171.6	175.4	0	0	111.9	K592 L593 G598	K592-E596 WeakPolarHBondContact CE-OE1 3.33Å; K592-E596 WeakPolarHBondContact O-CG 3.29Å; K592-E596 PolarHBondContact O-N 3.04Å; L593-E596 PolarHBondContact O-N 3.25Å; E596-G598 PolarHBondContact O-N 3.47Å
597	Q	82.3	Confident	86.1	Confident	84 Å²	84	40.6 Å²	40.6	39%	0.393	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	4.1	177.4	-62.7	-67	-34.6	0	0	113.8	F564 L593 F594 L595	F564-Q597 HydrophobicContact CB-CG 4.26Å; F564-Q597 HydrophobicContact CD1-CB 4.19Å; F564-Q597 HydrophobicContact CD1-CG 3.56Å; F564-Q597 HydrophobicContact CE1-CB 4.35Å; F564-Q597 HydrophobicContact CE1-CG 4.07Å; F564-Q597 HydrophobicContact CG-CG 3.97Å; L593-Q597 HydrophobicContact CD1-CG 4.35Å; L593-Q597 WeakPolarHBondContact O-CG 3.18Å; L593-Q597 PolarHBondContact O-N 3Å; F594-Q597 PolarHBondContact O-N 3.08Å; L595-Q597 VanDerWaalsContact C-N 3.27Å; L595-Q597 PolarHBondContact O-N 3.41Å
598	G	78	Confident	86	Confident	62 Å²	62	41.1 Å²	41.1	64%	0.639	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.9	24.1	173.6	0	0	0	0	0	115.6	F594 L595 E596 S600	F594-G598 PolarHBondContact O-N 3.06Å; L595-G598 PolarHBondContact O-N 2.84Å; L595-G598 VanDerWaalsContact O-N 3.11Å; E596-G598 PolarHBondContact O-N 3.47Å; G598-S600 PolarHBondContact O-N 2.92Å
599	F	85.4	Confident	85.9	Confident	26 Å²	26	39.7 Å²	39.7	11%	0.114	21%	0.211	C	C	.	.			trans	-62.6	124.3	173.6	-174.2	-87.2	0	0	0	112	L575 N576 M579 F594 L601 F604	L575-F599 HydrophobicContact CB-CD2 3.76Å; L575-F599 HydrophobicContact CB-CE2 3.78Å; L575-F599 HydrophobicContact CD1-CD2 4.41Å; N576-F599 VanDerWaalsContact OD1-CE2 3.29Å; N576-F599 WeakPolarHBondContact OD1-CE2 3.48Å; N576-F599 VanDerWaalsContact OD1-CZ 3.26Å; N576-F599 WeakPolarHBondContact OD1-CZ 3.4Å; M579-F599 HydrophobicContact CB-CE1 4.14Å; M579-F599 HydrophobicContact CB-CE2 4.04Å; M579-F599 HydrophobicContact CB-CZ 3.67Å; M579-F599 HydrophobicContact CE-CB 4.29Å; M579-F599 HydrophobicContact CE-CD1 3.42Å; M579-F599 VanDerWaalsContact CE-CD1 3.42Å; M579-F599 HydrophobicContact CE-CD2 4.37Å; M579-F599 HydrophobicContact CE-CE1 3.71Å; M579-F599 HydrophobicContact CE-CG 3.78Å; M579-F599 HydrophobicContact CE-CZ 4.31Å; M579-F599 HydrophobicContact CG-CD1 4.41Å; M579-F599 HydrophobicContact CG-CE1 3.71Å; M579-F599 HydrophobicContact CG-CZ 3.76Å; F594-F599 HydrophobicContact CB-CB 4.25Å; F594-F599 WeakPolarHBondContact O-CB 3.46Å; F594-F599 PolarHBondContact O-N 2.93Å; F599-L601 HydrophobicContact CD1-CD2 4.35Å; F599-L601 HydrophobicContact CE1-CD2 4.37Å; F599-L601 PolarHBondContact O-N 3.43Å; F599-F604 HydrophobicContact CE1-CB 3.5Å; F599-F604 VanDerWaalsContact CE1-CB 3.5Å; F599-F604 HydrophobicContact CE1-CD1 4.2Å; F599-F604 HydrophobicContact CE1-CD2 4.27Å; F599-F604 AromaticContact CE1-CG 3.74Å; F599-F604 HydrophobicContact CE1-CG 3.74Å; F599-F604 HydrophobicContact CZ-CB 3.63Å; F599-F604 AromaticContact CZ-CD2 3.78Å; F599-F604 HydrophobicContact CZ-CD2 3.78Å; F599-F604 AromaticContact CZ-CG 3.72Å; F599-F604 HydrophobicContact CZ-CG 3.72Å
600	S	84.5	Confident	85.9	Confident	49 Å²	49	36.6 Å²	36.6	34%	0.343	19%	0.194	S	C	.	.			trans	-82.2	105.7	-179.2	-179.7	0	0	0	0	111.8	G598 E602 D603 F604	G598-S600 PolarHBondContact O-N 2.92Å; S600-E602 PolarHBondContact O-N 2.6Å; S600-D603 PolarHBondContact O-N 2.89Å; S600-D603 PolarHBondContact OG-OD2 3.48Å; S600-F604 PolarHBondContact O-N 2.95Å
601	L	85.3	Confident	85.7	Confident	18 Å²	18	39 Å²	39	9%	0.094	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-27.2	173.8	-70.8	176.6	0	0	0	113.3	L595 F599 D603 F604 L605 P1161 L1165 F1181 M1184	L595-L601 HydrophobicContact CD2-CD1 3.73Å; L595-L601 HydrophobicContact CD2-CD2 3.95Å; L595-L601 HydrophobicContact CD2-CG 3.63Å; F599-L601 HydrophobicContact CD1-CD2 4.35Å; F599-L601 HydrophobicContact CE1-CD2 4.37Å; F599-L601 PolarHBondContact O-N 3.43Å; L601-D603 VanDerWaalsContact C-N 3.35Å; L601-F604 PolarHBondContact O-N 2.86Å; L601-L605 WeakPolarHBondContact O-CB 3.35Å; L601-L605 PolarHBondContact O-N 3.44Å; L601-P1161 HydrophobicContact CB-CB 4.21Å; L601-P1161 HydrophobicContact CB-CG 4Å; L601-L1165 HydrophobicContact CD1-CD1 4.48Å; L601-L1165 HydrophobicContact CD2-CD1 3.94Å; L601-F1181 HydrophobicContact CD1-CE1 4.34Å; L601-M1184 HydrophobicContact CD1-CE 3.96Å; L601-M1184 HydrophobicContact CD1-SD 3.89Å
602	E	82.4	Confident	85.6	Confident	95 Å²	95	42.4 Å²	42.4	44%	0.444	22%	0.22	S	C	.	.	H	α-helix	trans	-68.6	-33.6	-179.6	-65.6	-175.8	171.5	0	0	112	S600 P1161 K1186	S600-E602 PolarHBondContact O-N 2.6Å; E602-P1161 HydrophobicContact CG-CG 3.87Å; E602-K1186 IonicContact OE1-NZ 3.58Å
603	D	82.4	Confident	85.6	Confident	81 Å²	81	37.9 Å²	37.9	43%	0.433	20%	0.2	S	C	.	.	H	α-helix	trans	-82.6	-28.8	177.6	-66.7	-34	0	0	0	112.4	S600 L601 Q1157	S600-D603 PolarHBondContact O-N 2.89Å; S600-D603 PolarHBondContact OG-OD2 3.48Å; L601-D603 VanDerWaalsContact C-N 3.35Å; D603-Q1157 PolarHBondContact OD1-NE2 2.9Å
604	F	86.4	Confident	85.6	Confident	5 Å²	5	37.9 Å²	37.9	2%	0.022	20%	0.201	C	C	.	.	H	α-helix	trans	-80.4	-46.6	-178.7	172	-105.4	0	0	0	113.4	N576 M579 L583 F599 S600 L601 T606 M609	N576-F604 HydrophobicContact CB-CD2 4.01Å; N576-F604 HydrophobicContact CB-CE2 4.36Å; N576-F604 VanDerWaalsContact O-CE2 3.26Å; N576-F604 WeakPolarHBondContact O-CE2 3.38Å; M579-F604 HydrophobicContact CB-CE2 4.2Å; M579-F604 HydrophobicContact CB-CZ 4.29Å; M579-F604 HydrophobicContact CG-CD1 4.17Å; M579-F604 HydrophobicContact CG-CD2 4.43Å; M579-F604 HydrophobicContact CG-CE1 3.85Å; M579-F604 HydrophobicContact CG-CE2 4.13Å; M579-F604 HydrophobicContact CG-CG 4.44Å; M579-F604 HydrophobicContact CG-CZ 3.83Å; L583-F604 HydrophobicContact CD1-CE1 3.59Å; L583-F604 HydrophobicContact CD1-CZ 3.96Å; F599-F604 HydrophobicContact CE1-CB 3.5Å; F599-F604 VanDerWaalsContact CE1-CB 3.5Å; F599-F604 HydrophobicContact CE1-CD1 4.2Å; F599-F604 HydrophobicContact CE1-CD2 4.27Å; F599-F604 AromaticContact CE1-CG 3.74Å; F599-F604 HydrophobicContact CE1-CG 3.74Å; F599-F604 HydrophobicContact CZ-CB 3.63Å; F599-F604 AromaticContact CZ-CD2 3.78Å; F599-F604 HydrophobicContact CZ-CD2 3.78Å; F599-F604 AromaticContact CZ-CG 3.72Å; F599-F604 HydrophobicContact CZ-CG 3.72Å; S600-F604 PolarHBondContact O-N 2.95Å; L601-F604 PolarHBondContact O-N 2.86Å; F604-T606 PolarHBondContact O-N 2.81Å; F604-T606 VanDerWaalsContact O-N 3.1Å; F604-M609 HydrophobicContact CE2-CE 3.73Å; F604-M609 HydrophobicContact CZ-CE 3.87Å
605	L	87.3	Confident	85.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.			trans	-88.3	85.3	-170.2	-162.5	77.7	0	0	0	112	L601 L610 L613 L1158 P1161 E1164 L1165	L601-L605 WeakPolarHBondContact O-CB 3.35Å; L601-L605 PolarHBondContact O-N 3.44Å; L605-L610 HydrophobicContact CD1-CB 4.5Å; L605-L610 HydrophobicContact CD1-CD1 4.41Å; L605-L613 HydrophobicContact CD1-CD1 4.04Å; L605-L1158 HydrophobicContact CD2-CD1 3.8Å; L605-L1158 HydrophobicContact CG-CD1 3.88Å; L605-P1161 HydrophobicContact CB-CB 3.85Å; L605-P1161 HydrophobicContact CD2-CB 3.62Å; L605-P1161 WeakPolarHBondContact CD2-O 3.12Å; L605-P1161 HydrophobicContact CG-CB 4.39Å; L605-E1164 HydrophobicContact CD2-CB 3.93Å; L605-L1165 HydrophobicContact CD1-CD1 4.45Å; L605-L1165 HydrophobicContact CD1-CD2 3.84Å; L605-L1165 HydrophobicContact CD1-CG 4.12Å; L605-L1165 HydrophobicContact CD2-CD1 4.35Å; L605-L1165 HydrophobicContact CD2-CD2 4.48Å; L605-L1165 HydrophobicContact CD2-CG 3.91Å
606	T	84.8	Confident	85.3	Confident	14 Å²	14	38.4 Å²	38.4	9%	0.086	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-87.4	164.4	170.1	64.5	0	0	0	0	111.1	F604 Y608 M609 L610 K1154 I1156	F604-T606 PolarHBondContact O-N 2.81Å; F604-T606 VanDerWaalsContact O-N 3.1Å; T606-Y608 VanDerWaalsContact C-N 3.25Å; T606-Y608 PolarHBondContact O-N 2.97Å; T606-M609 PolarHBondContact O-N 3.41Å; T606-M609 VanDerWaalsContact O-N 3.16Å; T606-M609 WeakPolarHBondContact OG1-CG 3.31Å; T606-M609 PolarHBondContact OG1-N 2.97Å; T606-L610 PolarHBondContact O-N 3.01Å; T606-K1154 WeakPolarHBondContact CG2-O 3.36Å; T606-I1156 WeakPolarHBondContact CA-O 3.35Å
607	I	83.7	Confident	85.3	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-55.4	-44.3	174.5	-66.6	-179.2	0	0	0	111	M609 L610 E611 L645 F669 L673 I1156 L1158	I607-M609 PolarHBondContact O-N 3.42Å; I607-L610 PolarHBondContact O-N 3.34Å; I607-E611 PolarHBondContact O-N 3.2Å; I607-L645 HydrophobicContact CG2-CD1 3.87Å; I607-F669 HydrophobicContact CD1-CE2 4.35Å; I607-F669 HydrophobicContact CD1-CZ 4.15Å; I607-L673 HydrophobicContact CD1-CD1 3.78Å; I607-L673 HydrophobicContact CD1-CG 4.07Å; I607-L673 HydrophobicContact CG2-CD2 4.43Å; I607-I1156 HydrophobicContact CD1-CB 3.83Å; I607-I1156 HydrophobicContact CD1-CD1 4.32Å; I607-I1156 HydrophobicContact CD1-CG2 3.39Å; I607-I1156 HydrophobicContact CG1-CB 4.21Å; I607-I1156 HydrophobicContact CG1-CG2 4.05Å; I607-I1156 PolarHBondContact N-O 2.93Å; I607-I1156 VanDerWaalsContact N-O 3.13Å; I607-L1158 HydrophobicContact CG1-CD2 4.1Å; I607-L1158 HydrophobicContact CG1-CG 4.31Å
608	Y	83.8	Confident	85.2	Confident	65 Å²	65	30.5 Å²	30.5	26%	0.255	17%	0.168	S	C	.	.	H	α-helix	trans	-58.4	-47.2	175.8	172.2	-95.3	0	0	0	112.2	T606 L610 E611 K612 E1150 K1154	T606-Y608 VanDerWaalsContact C-N 3.25Å; T606-Y608 PolarHBondContact O-N 2.97Å; Y608-L610 VanDerWaalsContact C-N 3.32Å; Y608-L610 PolarHBondContact O-N 3.39Å; Y608-E611 PolarHBondContact O-N 3.08Å; Y608-K612 HydrophobicContact CE1-CD 4.22Å; Y608-K612 WeakPolarHBondContact O-CB 3.33Å; Y608-K612 PolarHBondContact O-N 3.33Å; Y608-E1150 HydrophobicContact CE2-CG 4.46Å; Y608-E1150 WeakPolarHBondContact CE2-OE1 3.28Å; Y608-K1154 HydrophobicContact CD1-CG 4.13Å; Y608-K1154 HydrophobicContact CD2-CG 4.43Å; Y608-K1154 HydrophobicContact CG-CG 4.02Å
609	M	87	Confident	85.1	Confident	30 Å²	30	34.5 Å²	34.5	15%	0.148	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-37.6	179.4	-75	-60.4	-67.5	0	0	112.1	Y580 F604 T606 I607 K612 L613	Y580-M609 HydrophobicContact CD2-CE 3.63Å; Y580-M609 HydrophobicContact CE2-CE 4.45Å; Y580-M609 HydrophobicContact CG-CE 4.21Å; F604-M609 HydrophobicContact CE2-CE 3.73Å; F604-M609 HydrophobicContact CZ-CE 3.87Å; T606-M609 PolarHBondContact O-N 3.41Å; T606-M609 VanDerWaalsContact O-N 3.16Å; T606-M609 WeakPolarHBondContact OG1-CG 3.31Å; T606-M609 PolarHBondContact OG1-N 2.97Å; I607-M609 PolarHBondContact O-N 3.42Å; M609-K612 WeakPolarHBondContact O-CB 3.36Å; M609-K612 PolarHBondContact O-N 2.65Å; M609-K612 HydrophobicContact SD-CD 4.3Å; M609-L613 WeakPolarHBondContact O-CB 3.49Å; M609-L613 VanDerWaalsContact O-CG 3.3Å; M609-L613 WeakPolarHBondContact O-CG 3.26Å; M609-L613 PolarHBondContact O-N 3.35Å
610	L	89.1	Confident	84.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.1	-42.9	176.3	-173.1	63.1	0	0	0	112.2	L605 T606 I607 Y608 K612 L613 Y614 L645 L1158 E1164	L605-L610 HydrophobicContact CD1-CB 4.5Å; L605-L610 HydrophobicContact CD1-CD1 4.41Å; T606-L610 PolarHBondContact O-N 3.01Å; I607-L610 PolarHBondContact O-N 3.34Å; Y608-L610 VanDerWaalsContact C-N 3.32Å; Y608-L610 PolarHBondContact O-N 3.39Å; L610-K612 VanDerWaalsContact C-N 3.32Å; L610-K612 PolarHBondContact O-N 2.9Å; L610-L613 PolarHBondContact O-N 3.21Å; L610-Y614 HydrophobicContact CD1-CD2 4.2Å; L610-Y614 HydrophobicContact CD1-CE2 3.78Å; L610-Y614 HydrophobicContact CD2-CE2 4.46Å; L610-Y614 HydrophobicContact CG-CD2 4.13Å; L610-Y614 HydrophobicContact CG-CE2 3.9Å; L610-Y614 VanDerWaalsContact O-CD2 3.3Å; L610-Y614 WeakPolarHBondContact O-CD2 3.23Å; L610-Y614 PolarHBondContact O-N 2.99Å; L610-L645 HydrophobicContact CD2-CD1 4.19Å; L610-L645 HydrophobicContact CD2-CD2 3.68Å; L610-L645 HydrophobicContact CG-CD2 3.88Å; L610-L1158 HydrophobicContact CB-CD1 4.33Å; L610-L1158 HydrophobicContact CD2-CD1 3.91Å; L610-E1164 HydrophobicContact CD2-CB 4.04Å
611	E	86.6	Confident	83.3	Confident	51 Å²	51	41 Å²	41	24%	0.238	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-37.6	174.4	-71.8	-173.4	155.9	0	0	112	I607 Y608 T615 L645	I607-E611 PolarHBondContact O-N 3.2Å; Y608-E611 PolarHBondContact O-N 3.08Å; E611-T615 VanDerWaalsContact O-CB 3.29Å; E611-T615 WeakPolarHBondContact O-CB 3.47Å; E611-T615 PolarHBondContact O-N 2.94Å; E611-T615 PolarHBondContact O-OG1 2.74Å; E611-L645 HydrophobicContact CG-CD1 4.31Å; E611-L645 HydrophobicContact CG-CD2 4.12Å; E611-L645 HydrophobicContact CG-CG 3.69Å; E611-L645 PolarHBondContact OE1-N 3.07Å
612	K	88.1	Confident	82.5	Confident	72 Å²	72	44.3 Å²	44.3	31%	0.313	22%	0.217	S	C	.	.	H	α-helix	trans	-61.3	-47.5	172.6	-173	180	-180	-169.5	0	111.2	Y580 Y608 M609 L610 Y614 T615 D616	Y580-K612 HydrophobicContact CE2-CD 4Å; Y580-K612 HydrophobicContact CE2-CG 4.08Å; Y608-K612 HydrophobicContact CE1-CD 4.22Å; Y608-K612 WeakPolarHBondContact O-CB 3.33Å; Y608-K612 PolarHBondContact O-N 3.33Å; M609-K612 WeakPolarHBondContact O-CB 3.36Å; M609-K612 PolarHBondContact O-N 2.65Å; M609-K612 HydrophobicContact SD-CD 4.3Å; L610-K612 VanDerWaalsContact C-N 3.32Å; L610-K612 PolarHBondContact O-N 2.9Å; K612-Y614 PolarHBondContact O-N 3.1Å; K612-T615 PolarHBondContact O-N 3.13Å; K612-D616 WeakPolarHBondContact CG-OD2 3.49Å; K612-D616 WeakPolarHBondContact O-CB 3.33Å; K612-D616 PolarHBondContact O-N 2.7Å
613	L	89.4	Confident	81.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-45.1	177.3	-76.2	170.8	0	0	0	112.8	Y580 L583 M584 L605 M609 L610 Q617 L1165 W1168	Y580-L613 HydrophobicContact CD2-CD2 3.78Å; Y580-L613 HydrophobicContact CD2-CG 4.42Å; Y580-L613 HydrophobicContact CE2-CD2 3.83Å; Y580-L613 HydrophobicContact CE2-CG 4.4Å; L583-L613 HydrophobicContact CB-CD2 4.37Å; L583-L613 HydrophobicContact CD1-CD1 4.42Å; M584-L613 HydrophobicContact CG-CD2 4.36Å; M584-L613 HydrophobicContact SD-CD2 3.89Å; L605-L613 HydrophobicContact CD1-CD1 4.04Å; M609-L613 WeakPolarHBondContact O-CB 3.49Å; M609-L613 VanDerWaalsContact O-CG 3.3Å; M609-L613 WeakPolarHBondContact O-CG 3.26Å; M609-L613 PolarHBondContact O-N 3.35Å; L610-L613 PolarHBondContact O-N 3.21Å; L613-Q617 WeakPolarHBondContact O-CB 3.5Å; L613-Q617 WeakPolarHBondContact O-CG 3.37Å; L613-Q617 PolarHBondContact O-N 2.8Å; L613-L1165 HydrophobicContact CD1-CD2 4.15Å; L613-W1168 HydrophobicContact CB-CZ2 4.46Å; L613-W1168 HydrophobicContact CD2-CZ2 4.23Å
614	Y	88.6	Confident	81.4	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	22%	0.215	C	C	.	.	H	α-helix	trans	-65.3	-42	175.4	-81.5	-73.1	0	0	0	112.1	L610 K612 L618 F628 L645 V648 W1168 L1171	L610-Y614 HydrophobicContact CD1-CD2 4.2Å; L610-Y614 HydrophobicContact CD1-CE2 3.78Å; L610-Y614 HydrophobicContact CD2-CE2 4.46Å; L610-Y614 HydrophobicContact CG-CD2 4.13Å; L610-Y614 HydrophobicContact CG-CE2 3.9Å; L610-Y614 VanDerWaalsContact O-CD2 3.3Å; L610-Y614 WeakPolarHBondContact O-CD2 3.23Å; L610-Y614 PolarHBondContact O-N 2.99Å; K612-Y614 PolarHBondContact O-N 3.1Å; Y614-L618 WeakPolarHBondContact O-CD1 3.19Å; Y614-L618 PolarHBondContact O-N 3.45Å; Y614-F628 HydrophobicContact CD1-CE1 4.09Å; Y614-F628 AromaticContact CD1-CZ 3.85Å; Y614-F628 HydrophobicContact CD1-CZ 3.85Å; Y614-F628 HydrophobicContact CE1-CZ 4.12Å; Y614-L645 HydrophobicContact CD2-CD2 4.22Å; Y614-L645 HydrophobicContact CE2-CD2 4.21Å; Y614-V648 HydrophobicContact CD1-CG2 4.37Å; Y614-V648 HydrophobicContact CD2-CG2 4.33Å; Y614-V648 HydrophobicContact CE1-CG1 4.17Å; Y614-V648 HydrophobicContact CE1-CG2 4.39Å; Y614-V648 HydrophobicContact CE2-CG1 4.37Å; Y614-V648 HydrophobicContact CE2-CG2 4.36Å; Y614-V648 HydrophobicContact CG-CG2 4.34Å; Y614-W1168 AromaticContact CD1-CD1 3.73Å; Y614-W1168 HydrophobicContact CE1-CB 4.35Å; Y614-W1168 AromaticContact CE1-CD1 3.62Å; Y614-W1168 HydrophobicContact CE1-CG 4.37Å; Y614-W1168 HydrophobicContact CE2-CB 4.35Å; Y614-W1168 AromaticContact CG-CD1 3.97Å; Y614-W1168 AromaticContact CZ-CD1 3.76Å; Y614-W1168 WeakPolarHBondContact OH-CA 3.44Å; Y614-L1171 HydrophobicContact CE1-CD1 4.23Å
615	T	86.7	Confident	80.8	Confident	16 Å²	16	42.5 Å²	42.5	10%	0.098	22%	0.215	C	C	.	.	H	α-helix	trans	-68.3	-43.8	-176.6	-59.4	0	0	0	0	112.2	E611 K612 L618 K642 V643	E611-T615 VanDerWaalsContact O-CB 3.29Å; E611-T615 WeakPolarHBondContact O-CB 3.47Å; E611-T615 PolarHBondContact O-N 2.94Å; E611-T615 PolarHBondContact O-OG1 2.74Å; K612-T615 PolarHBondContact O-N 3.13Å; T615-L618 PolarHBondContact O-N 2.76Å; T615-K642 HydrophobicContact CG2-CG 4.45Å; T615-V643 PolarHBondContact OG1-N 3.29Å; T615-V643 VanDerWaalsContact OG1-N 3.1Å
616	D	84.8	Confident	80	Confident	28 Å²	28	44.8 Å²	44.8	15%	0.15	23%	0.233	C	C	.	.	H	α-helix	trans	-74.8	-29.1	-177	-66.8	-33.5	0	0	0	112.2	Y580 M584 K612 L618 K619	Y580-D616 PolarHBondContact OH-OD2 2.74Å; M584-D616 HydrophobicContact CE-CB 3.6Å; M584-D616 HydrophobicContact SD-CB 4.32Å; K612-D616 WeakPolarHBondContact CG-OD2 3.49Å; K612-D616 WeakPolarHBondContact O-CB 3.33Å; K612-D616 PolarHBondContact O-N 2.7Å; D616-L618 VanDerWaalsContact C-N 3.33Å; D616-L618 PolarHBondContact O-N 2.78Å; D616-K619 PolarHBondContact O-N 2.78Å; D616-K619 IonicContact OD1-NZ 3.35Å; D616-K619 PolarHBondContact OD1-NZ 3.33Å
617	Q	83.7	Confident	79.6	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-35.5	172.3	-74	-68.5	-24.7	0	0	112.2	M584 L613 K619 N620 W1168 V1172	M584-Q617 HydrophobicContact CE-CG 3.97Å; M584-Q617 PolarHBondContact O-NE2 3.49Å; M584-Q617 VanDerWaalsContact O-NE2 3.15Å; M584-Q617 HydrophobicContact SD-CG 3.92Å; M584-Q617 PolarHBondContact SD-NE2 2.83Å; L613-Q617 WeakPolarHBondContact O-CB 3.5Å; L613-Q617 WeakPolarHBondContact O-CG 3.37Å; L613-Q617 PolarHBondContact O-N 2.8Å; Q617-K619 VanDerWaalsContact C-N 3.27Å; Q617-K619 PolarHBondContact O-N 3.46Å; Q617-N620 CarbonylContact O-C 3.01Å; Q617-N620 PolarHBondContact O-N 2.9Å; Q617-N620 VanDerWaalsContact O-O 3.07Å; Q617-W1168 HydrophobicContact CG-CZ2 3.81Å; Q617-V1172 HydrophobicContact CB-CG1 4.33Å; Q617-V1172 HydrophobicContact CB-CG2 4.43Å; Q617-V1172 HydrophobicContact CG-CG1 4.16Å; Q617-V1172 HydrophobicContact CG-CG2 4.44Å
618	L	80.7	Confident	79.6	Confident	21 Å²	21	45.4 Å²	45.4	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-68.6	-23.6	175.7	-80.7	155.4	0	0	0	113.7	Y614 T615 D616 N620 V625 F628 N629 W632 V643	Y614-L618 WeakPolarHBondContact O-CD1 3.19Å; Y614-L618 PolarHBondContact O-N 3.45Å; T615-L618 PolarHBondContact O-N 2.76Å; D616-L618 VanDerWaalsContact C-N 3.33Å; D616-L618 PolarHBondContact O-N 2.78Å; L618-N620 VanDerWaalsContact C-N 3.31Å; L618-V625 HydrophobicContact CD2-CG1 4.34Å; L618-F628 HydrophobicContact CD1-CE1 4.05Å; L618-F628 HydrophobicContact CD2-CD1 4.16Å; L618-F628 HydrophobicContact CD2-CE1 4.37Å; L618-F628 HydrophobicContact CG-CD1 4.44Å; L618-F628 HydrophobicContact CG-CE1 4.3Å; L618-N629 HydrophobicContact CD2-CB 3.58Å; L618-N629 VanDerWaalsContact CD2-OD1 3.31Å; L618-N629 WeakPolarHBondContact CD2-OD1 3.46Å; L618-W632 HydrophobicContact CD1-CD2 4.44Å; L618-W632 HydrophobicContact CD1-CE3 4.26Å; L618-V643 HydrophobicContact CD1-CB 4.48Å; L618-V643 HydrophobicContact CD1-CG2 3.03Å; L618-V643 HydrophobicContact CG-CG2 4.5Å
619	K	77.1	Confident	79.4	Confident	147 Å²	147	43.7 Å²	43.7	64%	0.639	23%	0.231	S	C	*	.	H	α-helix	trans	-72.5	-28.9	174	-64.7	174	-173.7	160.5	0	111.6	D616 Q617 L621	D616-K619 PolarHBondContact O-N 2.78Å; D616-K619 IonicContact OD1-NZ 3.35Å; D616-K619 PolarHBondContact OD1-NZ 3.33Å; Q617-K619 VanDerWaalsContact C-N 3.27Å; Q617-K619 PolarHBondContact O-N 3.46Å; K619-L621 PolarHBondContact O-N 2.75Å
620	N	68.8	Low	79.1	Confident	96 Å²	96	49.4 Å²	49.4	51%	0.513	26%	0.255	S	S	.	.	S	Bend	trans	-96.8	76	176.6	-158.4	6.7	0	0	0	109.2	Q617 L618 N622	Q617-N620 CarbonylContact O-C 3.01Å; Q617-N620 PolarHBondContact O-N 2.9Å; Q617-N620 VanDerWaalsContact O-O 3.07Å; L618-N620 VanDerWaalsContact C-N 3.31Å; N620-N622 PolarHBondContact O-N 3.42Å
621	L	62.7	Low	78.6	Confident	116 Å²	116	50.5 Å²	50.5	61%	0.607	26%	0.26	S	S	*	.			trans	-64.4	85.7	-173.7	-74	158.9	0	0	0	112.2	K619	K619-L621 PolarHBondContact O-N 2.75Å
622	N	68.2	Low	78.4	Confident	87 Å²	87	48.7 Å²	48.7	47%	0.465	25%	0.251	S	S	.	.			trans	-84.1	154.1	166.5	-69.9	-18.8	0	0	0	110.9	N620 K624 V625 A626	N620-N622 PolarHBondContact O-N 3.42Å; N622-K624 VanDerWaalsContact C-N 3.33Å; N622-K624 PolarHBondContact O-N 3.47Å; N622-V625 HydrophobicContact CB-CG2 4.16Å; N622-V625 PolarHBondContact O-N 2.87Å; N622-A626 PolarHBondContact O-N 3.26Å; N622-A626 VanDerWaalsContact O-N 3.1Å
623	S	67.1	Low	78	Confident	85 Å²	85	49.6 Å²	49.6	59%	0.594	26%	0.257	S	S	*	.	H	α-helix	trans	-52.4	-45.7	-180	56.2	0	0	0	0	113.1	V625 A626	S623-V625 VanDerWaalsContact C-N 3.32Å; S623-V625 PolarHBondContact O-N 2.95Å; S623-A626 WeakPolarHBondContact O-CB 3.48Å; S623-A626 PolarHBondContact O-N 2.85Å; S623-A626 VanDerWaalsContact O-N 3.1Å
624	K	74.9	Confident	77.5	Confident	56 Å²	56	59.2 Å²	59.2	24%	0.243	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-36	177.1	-61.2	-176.8	-166.2	-84.5	0	113	N622 A626 G1173 D1211 D1214	N622-K624 VanDerWaalsContact C-N 3.33Å; N622-K624 PolarHBondContact O-N 3.47Å; K624-A626 VanDerWaalsContact C-N 3.29Å; K624-A626 PolarHBondContact O-N 3.03Å; K624-G1173 WeakPolarHBondContact CD-O 3.23Å; K624-D1211 IonicContact NZ-OD1 2.98Å; K624-D1211 PolarHBondContact NZ-OD1 2.96Å; K624-D1214 IonicContact NZ-OD2 2.76Å; K624-D1214 PolarHBondContact NZ-OD2 3.23Å
625	V	74.1	Confident	76.9	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-73.9	-23	178.2	-176.5	0	0	0	0	111.2	L618 N622 S623 I627 F628 N629 V1172	L618-V625 HydrophobicContact CD2-CG1 4.34Å; N622-V625 HydrophobicContact CB-CG2 4.16Å; N622-V625 PolarHBondContact O-N 2.87Å; S623-V625 VanDerWaalsContact C-N 3.32Å; S623-V625 PolarHBondContact O-N 2.95Å; V625-I627 VanDerWaalsContact C-N 3.26Å; V625-I627 PolarHBondContact O-N 3.36Å; V625-F628 PolarHBondContact O-N 3.01Å; V625-F628 VanDerWaalsContact O-N 3.15Å; V625-N629 PolarHBondContact O-N 3.36Å; V625-V1172 HydrophobicContact CG2-CG1 3.79Å; V625-V1172 WeakPolarHBondContact CG2-O 3.44Å
626	A	70.6	Confident	76.3	Confident	47 Å²	47	65.3 Å²	65.3	39%	0.388	32%	0.318	S	S	.	.	H	α-helix	trans	-61.1	-33.3	179.6	0	0	0	0	0	112.7	N622 S623 K624 N629 K630	N622-A626 PolarHBondContact O-N 3.26Å; N622-A626 VanDerWaalsContact O-N 3.1Å; S623-A626 WeakPolarHBondContact O-CB 3.48Å; S623-A626 PolarHBondContact O-N 2.85Å; S623-A626 VanDerWaalsContact O-N 3.1Å; K624-A626 VanDerWaalsContact C-N 3.29Å; K624-A626 PolarHBondContact O-N 3.03Å; A626-N629 PolarHBondContact O-N 3.44Å; A626-K630 WeakPolarHBondContact O-CB 3.38Å; A626-K630 PolarHBondContact O-N 2.79Å
627	I	76.3	Confident	75.1	Confident	24 Å²	24	67.5 Å²	67.5	12%	0.123	34%	0.335	C	S	.	.	H	α-helix	trans	-64.2	-48.5	175.6	-59.1	167.6	0	0	0	109.9	V625 K630 M631 L1202 Y1215	V625-I627 VanDerWaalsContact C-N 3.26Å; V625-I627 PolarHBondContact O-N 3.36Å; I627-K630 PolarHBondContact O-N 2.84Å; I627-M631 WeakPolarHBondContact O-CB 3.33Å; I627-M631 WeakPolarHBondContact O-CG 3.26Å; I627-M631 PolarHBondContact O-N 2.93Å; I627-L1202 HydrophobicContact CG2-CD2 4.15Å; I627-Y1215 HydrophobicContact CD1-CE2 4.19Å
628	F	82.7	Confident	74.1	Confident	5 Å²	5	71.5 Å²	71.5	2%	0.022	35%	0.354	C	S	.	.	H	α-helix	trans	-63.1	-41.9	175.5	174.9	-105.7	0	0	0	111.4	Y614 L618 V625 K630 M631 W632 V648 V651 L1171	Y614-F628 HydrophobicContact CD1-CE1 4.09Å; Y614-F628 AromaticContact CD1-CZ 3.85Å; Y614-F628 HydrophobicContact CD1-CZ 3.85Å; Y614-F628 HydrophobicContact CE1-CZ 4.12Å; L618-F628 HydrophobicContact CD1-CE1 4.05Å; L618-F628 HydrophobicContact CD2-CD1 4.16Å; L618-F628 HydrophobicContact CD2-CE1 4.37Å; L618-F628 HydrophobicContact CG-CD1 4.44Å; L618-F628 HydrophobicContact CG-CE1 4.3Å; V625-F628 PolarHBondContact O-N 3.01Å; V625-F628 VanDerWaalsContact O-N 3.15Å; F628-K630 PolarHBondContact O-N 2.97Å; F628-M631 PolarHBondContact O-N 3.41Å; F628-W632 HydrophobicContact CE1-CB 4.48Å; F628-W632 HydrophobicContact CZ-CB 4.39Å; F628-W632 VanDerWaalsContact O-CB 3.28Å; F628-W632 WeakPolarHBondContact O-CB 3.29Å; F628-W632 PolarHBondContact O-N 3.45Å; F628-V648 HydrophobicContact CZ-CG2 4.38Å; F628-V651 HydrophobicContact CD2-CG1 4.26Å; F628-V651 HydrophobicContact CE2-CG1 4.18Å; F628-L1171 WeakPolarHBondContact CB-O 3.48Å; F628-L1171 HydrophobicContact CD2-CB 4.09Å; F628-L1171 HydrophobicContact CD2-CD1 4.49Å; F628-L1171 HydrophobicContact CE2-CB 4.4Å; F628-L1171 HydrophobicContact CE2-CD1 4.14Å
629	N	81.1	Confident	73.2	Confident	29 Å²	29	82.6 Å²	82.6	16%	0.155	39%	0.394	C	S	.	.	H	α-helix	trans	-59.3	-48.7	176.6	-172	36.5	0	0	0	111.2	L618 V625 A626 M631 W632 E633	L618-N629 HydrophobicContact CD2-CB 3.58Å; L618-N629 VanDerWaalsContact CD2-OD1 3.31Å; L618-N629 WeakPolarHBondContact CD2-OD1 3.46Å; V625-N629 PolarHBondContact O-N 3.36Å; A626-N629 PolarHBondContact O-N 3.44Å; N629-M631 VanDerWaalsContact C-N 3.29Å; N629-M631 PolarHBondContact O-N 2.92Å; N629-W632 PolarHBondContact O-N 3.38Å; N629-E633 PolarHBondContact ND2-OE1 2.8Å; N629-E633 WeakPolarHBondContact O-CB 3.38Å; N629-E633 VanDerWaalsContact O-CG 3.31Å; N629-E633 WeakPolarHBondContact O-CG 3.34Å; N629-E633 PolarHBondContact O-N 2.66Å; N629-E633 PolarHBondContact OD1-OE1 2.91Å
630	K	79.9	Confident	72.5	Confident	151 Å²	151	79 Å²	79	66%	0.657	39%	0.385	S	S	*	.	H	α-helix	trans	-58.7	-40.9	176.7	-172	175.9	-177.3	178.7	0	111.9	A626 I627 F628 Y634	A626-K630 WeakPolarHBondContact O-CB 3.38Å; A626-K630 PolarHBondContact O-N 2.79Å; I627-K630 PolarHBondContact O-N 2.84Å; F628-K630 PolarHBondContact O-N 2.97Å; K630-Y634 WeakPolarHBondContact O-CB 3.43Å; K630-Y634 PolarHBondContact O-N 2.82Å
631	M	78.6	Confident	72.4	Confident	22 Å²	22	79.5 Å²	79.5	11%	0.108	40%	0.396	C	S	.	.	H	α-helix	trans	-71.1	-38.6	177.1	-74.6	-161.4	65.6	0	0	113.3	I627 F628 N629 Y634 N635 V651 A654 L655 K1205	I627-M631 WeakPolarHBondContact O-CB 3.33Å; I627-M631 WeakPolarHBondContact O-CG 3.26Å; I627-M631 PolarHBondContact O-N 2.93Å; F628-M631 PolarHBondContact O-N 3.41Å; N629-M631 VanDerWaalsContact C-N 3.29Å; N629-M631 PolarHBondContact O-N 2.92Å; M631-Y634 PolarHBondContact O-N 2.83Å; M631-N635 WeakPolarHBondContact O-CB 3.32Å; M631-N635 PolarHBondContact O-N 3.2Å; M631-N635 VanDerWaalsContact O-N 3.16Å; M631-N635 PolarHBondContact O-ND2 3.19Å; M631-V651 HydrophobicContact CB-CG1 4.32Å; M631-V651 HydrophobicContact CB-CG2 4.48Å; M631-V651 HydrophobicContact CE-CG1 4.06Å; M631-A654 HydrophobicContact CE-CB 4.43Å; M631-L655 HydrophobicContact CE-CD1 4.35Å; M631-L655 HydrophobicContact CE-CD2 3.82Å; M631-L655 HydrophobicContact CE-CG 3.78Å; M631-L655 HydrophobicContact SD-CD1 4.4Å; M631-L655 HydrophobicContact SD-CD2 3.77Å; M631-L655 HydrophobicContact SD-CG 4.19Å; M631-K1205 HydrophobicContact CE-CD 4.46Å; M631-K1205 HydrophobicContact SD-CD 3.79Å
632	W	83.1	Confident	73	Confident	13 Å²	13	80.6 Å²	80.6	5%	0.049	40%	0.396	C	S	.	.	H	α-helix	trans	-69.4	-44.1	177	173.4	71.9	0	0	0	110.9	L618 F628 N629 Y634 N635 R636 V643	L618-W632 HydrophobicContact CD1-CD2 4.44Å; L618-W632 HydrophobicContact CD1-CE3 4.26Å; F628-W632 HydrophobicContact CE1-CB 4.48Å; F628-W632 HydrophobicContact CZ-CB 4.39Å; F628-W632 VanDerWaalsContact O-CB 3.28Å; F628-W632 WeakPolarHBondContact O-CB 3.29Å; F628-W632 PolarHBondContact O-N 3.45Å; N629-W632 PolarHBondContact O-N 3.38Å; W632-Y634 PolarHBondContact O-N 3.09Å; W632-N635 CarbonylContact O-C 3.57Å; W632-N635 PolarHBondContact O-N 3.35Å; W632-R636 WeakPolarHBondContact O-CB 3.42Å; W632-R636 PolarHBondContact O-N 3.34Å; W632-V643 HydrophobicContact CD2-CG2 4.34Å; W632-V643 HydrophobicContact CH2-CG2 4.5Å; W632-V643 HydrophobicContact CZ2-CG2 3.94Å
633	E	79.5	Confident	73.6	Confident	92 Å²	92	76.6 Å²	76.6	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-57.1	-35.7	173.7	-77.6	179.6	-177.2	0	0	112.4	N629 R636	N629-E633 PolarHBondContact ND2-OE1 2.8Å; N629-E633 WeakPolarHBondContact O-CB 3.38Å; N629-E633 VanDerWaalsContact O-CG 3.31Å; N629-E633 WeakPolarHBondContact O-CG 3.34Å; N629-E633 PolarHBondContact O-N 2.66Å; N629-E633 PolarHBondContact OD1-OE1 2.91Å; E633-R636 WeakPolarHBondContact O-CG 3.16Å
634	Y	78.1	Confident	74.2	Confident	201 Å²	201	73.8 Å²	73.8	79%	0.788	36%	0.357	S	S	*	.	H	α-helix	trans	-72.1	-32.2	174.3	-175	-95.4	0	0	0	113.2	K630 M631 W632	K630-Y634 WeakPolarHBondContact O-CB 3.43Å; K630-Y634 PolarHBondContact O-N 2.82Å; M631-Y634 PolarHBondContact O-N 2.83Å; W632-Y634 PolarHBondContact O-N 3.09Å
635	N	76.2	Confident	74.7	Confident	32 Å²	32	71.3 Å²	71.3	17%	0.171	35%	0.346	C	S	.	.	H	α-helix	trans	-100.9	-8.1	-173.7	-75.6	-74.3	0	0	0	114.9	M631 W632 S637 K650 V651	M631-N635 WeakPolarHBondContact O-CB 3.32Å; M631-N635 PolarHBondContact O-N 3.2Å; M631-N635 VanDerWaalsContact O-N 3.16Å; M631-N635 PolarHBondContact O-ND2 3.19Å; W632-N635 CarbonylContact O-C 3.57Å; W632-N635 PolarHBondContact O-N 3.35Å; N635-S637 PolarHBondContact O-N 2.83Å; N635-K650 HydrophobicContact CB-CB 4.14Å; N635-K650 HydrophobicContact CB-CD 4.45Å; N635-K650 WeakPolarHBondContact O-CD 3.35Å; N635-K650 PolarHBondContact O-NZ 3.25Å; N635-V651 HydrophobicContact CB-CG2 4.01Å
636	R	73.5	Confident	75.2	Confident	113 Å²	113	76.5 Å²	76.5	43%	0.426	37%	0.365	S	S	.	.			trans	-64.1	129.7	-175.1	67.5	-175.6	173.8	171.9	-2.6	111.8	W632 E633 H638	W632-R636 WeakPolarHBondContact O-CB 3.42Å; W632-R636 PolarHBondContact O-N 3.34Å; E633-R636 WeakPolarHBondContact O-CG 3.16Å; R636-H638 VanDerWaalsContact C-N 3.25Å; R636-H638 PolarHBondContact O-N 3.21Å
637	S	61.2	Low	75.9	Confident	74 Å²	74	74.3 Å²	74.3	52%	0.517	35%	0.347	S	S	.	.	S	Bend	trans	-82.4	1.2	174.2	-97.3	0	0	0	0	113.8	N635 D647 K650	N635-S637 PolarHBondContact O-N 2.83Å; S637-D647 PolarHBondContact N-OD1 3.44Å; S637-K650 PolarHBondContact OG-NZ 3.3Å
638	H	61.6	Low	76.5	Confident	89 Å²	89	73.1 Å²	73.1	41%	0.412	34%	0.341	S	S	.	.	S	Bend	trans	-144.5	152.5	-160.4	-53.9	-66.3	0	0	0	111.9	R636 T640 D647	R636-H638 VanDerWaalsContact C-N 3.25Å; R636-H638 PolarHBondContact O-N 3.21Å; H638-T640 HydrophobicContact CB-CG2 4.17Å; H638-T640 WeakPolarHBondContact CB-OG1 3.17Å; H638-T640 PolarHBondContact O-N 2.9Å; H638-D647 IonicContact CD2-OD2 3.15Å
639	R	61.5	Low	76.7	Confident	253 Å²	253	72.9 Å²	72.9	96%	0.955	34%	0.34	S	S	*	.	S	Bend	trans	-83	11.6	164.2	-76.3	-168.5	-178.5	-171.8	1.4	113
640	T	62.5	Low	77	Confident	72 Å²	72	73.9 Å²	73.9	44%	0.442	34%	0.343	S	S	.	.			trans	-75.1	139.6	179.5	54.6	0	0	0	0	110.6	H638 K642	H638-T640 HydrophobicContact CB-CG2 4.17Å; H638-T640 WeakPolarHBondContact CB-OG1 3.17Å; H638-T640 PolarHBondContact O-N 2.9Å; T640-K642 VanDerWaalsContact C-N 3.27Å; T640-K642 PolarHBondContact OG1-O 3.01Å
641	S	67	Low	77.4	Confident	107 Å²	107	66.7 Å²	66.7	75%	0.748	31%	0.312	S	S	*	.	S	Bend	trans	-74.4	-17.2	173.5	56.8	0	0	0	0	113.4
642	K	74.9	Confident	77.9	Confident	139 Å²	139	65.8 Å²	65.8	60%	0.604	31%	0.307	S	S	*	.	S	Bend	trans	-81.3	138.8	176.7	-62.9	-176.2	179.2	-179.4	0	111	T615 T640	T615-K642 HydrophobicContact CG2-CG 4.45Å; T640-K642 VanDerWaalsContact C-N 3.27Å; T640-K642 PolarHBondContact OG1-O 3.01Å
643	V	81.3	Confident	78.2	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.012	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-82.8	117.9	174.8	-178.1	0	0	0	0	110	T615 L618 W632 V648	T615-V643 PolarHBondContact OG1-N 3.29Å; T615-V643 VanDerWaalsContact OG1-N 3.1Å; L618-V643 HydrophobicContact CD1-CB 4.48Å; L618-V643 HydrophobicContact CD1-CG2 3.03Å; L618-V643 HydrophobicContact CG-CG2 4.5Å; W632-V643 HydrophobicContact CD2-CG2 4.34Å; W632-V643 HydrophobicContact CH2-CG2 4.5Å; W632-V643 HydrophobicContact CZ2-CG2 3.94Å; V643-V648 HydrophobicContact CG1-CG2 3.53Å
644	A	80.6	Confident	78.5	Confident	27 Å²	27	66.8 Å²	66.8	22%	0.223	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-85.9	142.2	169.4	0	0	0	0	0	110.9	R646 D647 V648	A644-R646 PolarHBondContact O-N 2.76Å; A644-D647 PolarHBondContact O-N 3.33Å; A644-V648 PolarHBondContact O-N 3.08Å
645	L	84.5	Confident	78.9	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-58.3	-26.1	177.1	-65.6	179.2	0	0	0	113.4	I607 L610 E611 Y614 D647 V648 G649 Y664 F669	I607-L645 HydrophobicContact CG2-CD1 3.87Å; L610-L645 HydrophobicContact CD2-CD1 4.19Å; L610-L645 HydrophobicContact CD2-CD2 3.68Å; L610-L645 HydrophobicContact CG-CD2 3.88Å; E611-L645 HydrophobicContact CG-CD1 4.31Å; E611-L645 HydrophobicContact CG-CD2 4.12Å; E611-L645 HydrophobicContact CG-CG 3.69Å; E611-L645 PolarHBondContact OE1-N 3.07Å; Y614-L645 HydrophobicContact CD2-CD2 4.22Å; Y614-L645 HydrophobicContact CE2-CD2 4.21Å; L645-D647 VanDerWaalsContact C-N 3.32Å; L645-D647 PolarHBondContact O-N 3.38Å; L645-V648 PolarHBondContact O-N 2.73Å; L645-G649 PolarHBondContact O-N 3.46Å; L645-Y664 HydrophobicContact CB-CD1 4.37Å; L645-Y664 HydrophobicContact CB-CG 4.21Å; L645-Y664 VanDerWaalsContact O-CB 3.25Å; L645-Y664 WeakPolarHBondContact O-CB 3.38Å; L645-Y664 WeakPolarHBondContact O-CD2 3.18Å; L645-F669 HydrophobicContact CB-CE1 4.41Å; L645-F669 HydrophobicContact CD1-CE1 4.04Å; L645-F669 HydrophobicContact CD1-CZ 3.71Å
646	R	84.3	Confident	79.3	Confident	112 Å²	112	56.6 Å²	56.6	42%	0.423	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-40.7	174.5	-177.3	-176.7	-70.1	-130	0.1	111.9	A644 G649 K650 L665	A644-R646 PolarHBondContact O-N 2.76Å; R646-G649 PolarHBondContact O-N 2.76Å; R646-K650 PolarHBondContact O-N 2.84Å; R646-K650 VanDerWaalsContact O-N 3.17Å; R646-L665 HydrophobicContact CG-CD2 3.97Å
647	D	85.8	Confident	79.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-71.4	-38.7	179.7	-66	-33.4	0	0	0	110.5	S637 H638 A644 L645 G649 K650 V651	S637-D647 PolarHBondContact N-OD1 3.44Å; H638-D647 IonicContact CD2-OD2 3.15Å; A644-D647 PolarHBondContact O-N 3.33Å; L645-D647 VanDerWaalsContact C-N 3.32Å; L645-D647 PolarHBondContact O-N 3.38Å; D647-G649 VanDerWaalsContact C-N 3.25Å; D647-G649 PolarHBondContact O-N 3.05Å; D647-K650 WeakPolarHBondContact O-CB 3.3Å; D647-K650 PolarHBondContact O-N 2.98Å; D647-K650 VanDerWaalsContact O-N 3.13Å; D647-K650 IonicContact OD1-NZ 3.19Å; D647-K650 PolarHBondContact OD1-NZ 2.89Å; D647-V651 WeakPolarHBondContact O-CG2 3.31Å; D647-V651 PolarHBondContact O-N 2.85Å; D647-V651 VanDerWaalsContact O-N 3.08Å
648	V	87.7	Confident	80.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-40.4	169.4	-173.7	0	0	0	0	110.9	Y614 F628 V643 A644 L645 K650 V651 I652 Y664 L1171	Y614-V648 HydrophobicContact CD1-CG2 4.37Å; Y614-V648 HydrophobicContact CD2-CG2 4.33Å; Y614-V648 HydrophobicContact CE1-CG1 4.17Å; Y614-V648 HydrophobicContact CE1-CG2 4.39Å; Y614-V648 HydrophobicContact CE2-CG1 4.37Å; Y614-V648 HydrophobicContact CE2-CG2 4.36Å; Y614-V648 HydrophobicContact CG-CG2 4.34Å; F628-V648 HydrophobicContact CZ-CG2 4.38Å; V643-V648 HydrophobicContact CG1-CG2 3.53Å; A644-V648 PolarHBondContact O-N 3.08Å; L645-V648 PolarHBondContact O-N 2.73Å; V648-K650 VanDerWaalsContact C-N 3.33Å; V648-K650 PolarHBondContact O-N 3.02Å; V648-V651 WeakPolarHBondContact O-CB 3.02Å; V648-V651 PolarHBondContact O-N 3.35Å; V648-I652 HydrophobicContact CG1-CD1 4.1Å; V648-I652 HydrophobicContact CG1-CG1 4.49Å; V648-I652 WeakPolarHBondContact O-CG1 3.43Å; V648-I652 PolarHBondContact O-N 3.15Å; V648-Y664 HydrophobicContact CB-CD2 4.16Å; V648-Y664 HydrophobicContact CB-CE2 4.18Å; V648-Y664 HydrophobicContact CG1-CD2 4.2Å; V648-Y664 HydrophobicContact CG1-CE2 3.8Å; V648-L1171 HydrophobicContact CG1-CD1 3.89Å
649	G	88.2	Confident	80.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-40.7	175.5	0	0	0	0	0	113.2	L645 R646 D647 I652 K653 P662	L645-G649 PolarHBondContact O-N 3.46Å; R646-G649 PolarHBondContact O-N 2.76Å; D647-G649 VanDerWaalsContact C-N 3.25Å; D647-G649 PolarHBondContact O-N 3.05Å; G649-I652 PolarHBondContact O-N 3Å; G649-K653 PolarHBondContact O-N 3.22Å; G649-P662 VanDerWaalsContact O-CG 3.28Å; G649-P662 WeakPolarHBondContact O-CG 3.43Å
650	K	86.7	Confident	81.8	Confident	49 Å²	49	38.1 Å²	38.1	21%	0.213	21%	0.211	C	C	.	.	H	α-helix	trans	-66.9	-41.2	175.1	-63.3	173.2	-170	152.1	0	111.8	N635 S637 R646 D647 V648 I652 K653 A654 L665	N635-K650 HydrophobicContact CB-CB 4.14Å; N635-K650 HydrophobicContact CB-CD 4.45Å; N635-K650 WeakPolarHBondContact O-CD 3.35Å; N635-K650 PolarHBondContact O-NZ 3.25Å; S637-K650 PolarHBondContact OG-NZ 3.3Å; R646-K650 PolarHBondContact O-N 2.84Å; R646-K650 VanDerWaalsContact O-N 3.17Å; D647-K650 WeakPolarHBondContact O-CB 3.3Å; D647-K650 PolarHBondContact O-N 2.98Å; D647-K650 VanDerWaalsContact O-N 3.13Å; D647-K650 IonicContact OD1-NZ 3.19Å; D647-K650 PolarHBondContact OD1-NZ 2.89Å; V648-K650 VanDerWaalsContact C-N 3.33Å; V648-K650 PolarHBondContact O-N 3.02Å; K650-I652 VanDerWaalsContact C-N 3.33Å; K650-I652 PolarHBondContact O-N 2.92Å; K650-K653 PolarHBondContact O-N 3.07Å; K650-A654 WeakPolarHBondContact O-CB 3.42Å; K650-A654 PolarHBondContact O-N 2.95Å; K650-L665 HydrophobicContact CG-CD2 4.17Å
651	V	88.3	Confident	82.7	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-58.2	-46.2	175.6	170.7	0	0	0	0	110.5	F628 M631 N635 D647 V648 K653 A654 L655	F628-V651 HydrophobicContact CD2-CG1 4.26Å; F628-V651 HydrophobicContact CE2-CG1 4.18Å; M631-V651 HydrophobicContact CB-CG1 4.32Å; M631-V651 HydrophobicContact CB-CG2 4.48Å; M631-V651 HydrophobicContact CE-CG1 4.06Å; N635-V651 HydrophobicContact CB-CG2 4.01Å; D647-V651 WeakPolarHBondContact O-CG2 3.31Å; D647-V651 PolarHBondContact O-N 2.85Å; D647-V651 VanDerWaalsContact O-N 3.08Å; V648-V651 WeakPolarHBondContact O-CB 3.02Å; V648-V651 PolarHBondContact O-N 3.35Å; V651-K653 PolarHBondContact O-N 2.82Å; V651-A654 PolarHBondContact O-N 2.77Å; V651-L655 HydrophobicContact CG1-CD1 4.04Å; V651-L655 WeakPolarHBondContact O-CG 3.47Å; V651-L655 PolarHBondContact O-N 3.23Å
652	I	89.8	Confident	83.4	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-43.8	176.5	-64.6	166.9	0	0	0	111.1	V648 G649 K650 A654 L655 V656 Y660 P662 Y664 I1167 L1171	V648-I652 HydrophobicContact CG1-CD1 4.1Å; V648-I652 HydrophobicContact CG1-CG1 4.49Å; V648-I652 WeakPolarHBondContact O-CG1 3.43Å; V648-I652 PolarHBondContact O-N 3.15Å; G649-I652 PolarHBondContact O-N 3Å; K650-I652 VanDerWaalsContact C-N 3.33Å; K650-I652 PolarHBondContact O-N 2.92Å; I652-A654 VanDerWaalsContact C-N 3.27Å; I652-A654 PolarHBondContact O-N 3.07Å; I652-L655 PolarHBondContact O-N 3.16Å; I652-L655 VanDerWaalsContact O-N 3.12Å; I652-V656 HydrophobicContact CG2-CG2 4.09Å; I652-V656 WeakPolarHBondContact O-CG2 3.45Å; I652-V656 PolarHBondContact O-N 3.11Å; I652-Y660 HydrophobicContact CG2-CD1 4.11Å; I652-Y660 HydrophobicContact CG2-CE1 3.71Å; I652-P662 HydrophobicContact CB-CB 4.43Å; I652-P662 HydrophobicContact CB-CG 4.18Å; I652-P662 HydrophobicContact CG2-CB 4.33Å; I652-P662 HydrophobicContact CG2-CG 4.03Å; I652-Y664 HydrophobicContact CD1-CD2 4.14Å; I652-Y664 HydrophobicContact CD1-CE2 3.83Å; I652-I1167 HydrophobicContact CD1-CG2 3.81Å; I652-I1167 HydrophobicContact CG1-CG2 4.47Å; I652-L1171 HydrophobicContact CG1-CD1 4.28Å
653	K	88.2	Confident	83.8	Confident	69 Å²	69	30.3 Å²	30.3	30%	0.3	16%	0.16	S	C	.	.	H	α-helix	trans	-59	-40.5	176.1	-164.7	171.6	-170.5	-87.8	0	111.7	G649 K650 V651 L655 G657 D658 P662 L665	G649-K653 PolarHBondContact O-N 3.22Å; K650-K653 PolarHBondContact O-N 3.07Å; V651-K653 PolarHBondContact O-N 2.82Å; K653-L655 VanDerWaalsContact C-N 3.31Å; K653-L655 PolarHBondContact O-N 2.93Å; K653-G657 WeakPolarHBondContact O-CA 3.35Å; K653-G657 PolarHBondContact O-N 3.18Å; K653-D658 IonicContact NZ-OD1 2.65Å; K653-D658 PolarHBondContact NZ-OD1 3.43Å; K653-P662 HydrophobicContact CB-CG 3.87Å; K653-L665 HydrophobicContact CB-CD1 4.35Å; K653-L665 HydrophobicContact CD-CD1 4.05Å
654	A	85.6	Confident	83.9	Confident	56 Å²	56	30.4 Å²	30.4	46%	0.463	16%	0.161	S	C	.	.	H	α-helix	trans	-72.6	-19.8	178	0	0	0	0	0	113.9	M631 K650 V651 I652	M631-A654 HydrophobicContact CE-CB 4.43Å; K650-A654 WeakPolarHBondContact O-CB 3.42Å; K650-A654 PolarHBondContact O-N 2.95Å; V651-A654 PolarHBondContact O-N 2.77Å; I652-A654 VanDerWaalsContact C-N 3.27Å; I652-A654 PolarHBondContact O-N 3.07Å
655	L	87.2	Confident	83.9	Confident	7 Å²	7	31.6 Å²	31.6	4%	0.037	16%	0.163	C	C	.	.	H	α-helix	trans	-90.1	-40.1	176	-74.5	169.2	0	0	0	112.8	M631 V651 I652 K653 L1171 L1198 S1201 L1202 K1205	M631-L655 HydrophobicContact CE-CD1 4.35Å; M631-L655 HydrophobicContact CE-CD2 3.82Å; M631-L655 HydrophobicContact CE-CG 3.78Å; M631-L655 HydrophobicContact SD-CD1 4.4Å; M631-L655 HydrophobicContact SD-CD2 3.77Å; M631-L655 HydrophobicContact SD-CG 4.19Å; V651-L655 HydrophobicContact CG1-CD1 4.04Å; V651-L655 WeakPolarHBondContact O-CG 3.47Å; V651-L655 PolarHBondContact O-N 3.23Å; I652-L655 PolarHBondContact O-N 3.16Å; I652-L655 VanDerWaalsContact O-N 3.12Å; K653-L655 VanDerWaalsContact C-N 3.31Å; K653-L655 PolarHBondContact O-N 2.93Å; L655-L1171 HydrophobicContact CD1-CD2 3.67Å; L655-L1198 HydrophobicContact CB-CD2 3.79Å; L655-L1198 HydrophobicContact CD1-CD2 4.08Å; L655-S1201 WeakPolarHBondContact O-CB 3.2Å; L655-S1201 PolarHBondContact O-OG 3.14Å; L655-L1202 HydrophobicContact CD1-CD2 4.28Å; L655-L1202 HydrophobicContact CD2-CD2 4.22Å; L655-L1202 HydrophobicContact CD2-CG 4.47Å; L655-K1205 HydrophobicContact CD2-CD 4.05Å
656	V	85.7	Confident	83.5	Confident	13 Å²	13	32.6 Å²	32.6	8%	0.079	17%	0.17	C	C	.	.	H	α-helix	trans	-88.5	-40.1	-175.4	-177.9	0	0	0	0	111.7	I652 F659 Y660 L1194 I1197 L1198	I652-V656 HydrophobicContact CG2-CG2 4.09Å; I652-V656 WeakPolarHBondContact O-CG2 3.45Å; I652-V656 PolarHBondContact O-N 3.11Å; V656-F659 HydrophobicContact CG1-CE1 4.08Å; V656-F659 HydrophobicContact CG1-CE2 4.05Å; V656-F659 HydrophobicContact CG1-CZ 3.5Å; V656-F659 WeakPolarHBondContact O-CE1 3.38Å; V656-Y660 HydrophobicContact CB-CD1 4.2Å; V656-Y660 HydrophobicContact CB-CG 4.17Å; V656-Y660 HydrophobicContact CG1-CD1 4.18Å; V656-Y660 HydrophobicContact CG1-CD2 4.12Å; V656-Y660 HydrophobicContact CG1-CG 3.66Å; V656-Y660 HydrophobicContact CG2-CD1 4.29Å; V656-L1194 HydrophobicContact CG2-CD1 3.94Å; V656-I1197 HydrophobicContact CG1-CG2 4.18Å; V656-I1197 HydrophobicContact CG2-CG2 4.47Å; V656-L1198 HydrophobicContact CG2-CD2 3.62Å; V656-L1198 HydrophobicContact CG2-CG 4.23Å
657	G	79	Confident	83	Confident	26 Å²	26	32.3 Å²	32.3	27%	0.268	17%	0.172	S	C	.	.			trans	115.3	169.7	-175.9	0	0	0	0	0	113.3	K653 F659 Y660	K653-G657 WeakPolarHBondContact O-CA 3.35Å; K653-G657 PolarHBondContact O-N 3.18Å; G657-F659 VanDerWaalsContact C-N 3.27Å; G657-F659 PolarHBondContact O-N 3.23Å; G657-Y660 PolarHBondContact O-N 2.92Å
658	D	73.8	Confident	82.4	Confident	81 Å²	81	36.7 Å²	36.7	43%	0.433	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-17.6	-171.1	-74.2	-38.9	0	0	0	114.8	K653 Y660 I1441	K653-D658 IonicContact NZ-OD1 2.65Å; K653-D658 PolarHBondContact NZ-OD1 3.43Å; D658-Y660 PolarHBondContact O-N 3.37Å; D658-I1441 HydrophobicContact CB-CD1 3.77Å; D658-I1441 HydrophobicContact CB-CG1 4.41Å
659	F	74.8	Confident	81.9	Confident	31 Å²	31	37.4 Å²	37.4	14%	0.136	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.9	174.6	71.3	-91.1	0	0	0	112.1	V656 G657 L1260 E1263	V656-F659 HydrophobicContact CG1-CE1 4.08Å; V656-F659 HydrophobicContact CG1-CE2 4.05Å; V656-F659 HydrophobicContact CG1-CZ 3.5Å; V656-F659 WeakPolarHBondContact O-CE1 3.38Å; G657-F659 VanDerWaalsContact C-N 3.27Å; G657-F659 PolarHBondContact O-N 3.23Å; F659-L1260 HydrophobicContact CE2-CD2 3.94Å; F659-E1263 HydrophobicContact CD1-CB 3.87Å; F659-E1263 HydrophobicContact CD1-CG 3.99Å; F659-E1263 HydrophobicContact CD2-CB 4.1Å; F659-E1263 HydrophobicContact CD2-CG 3.96Å; F659-E1263 HydrophobicContact CE1-CB 3.51Å; F659-E1263 HydrophobicContact CE1-CG 4.15Å; F659-E1263 HydrophobicContact CE2-CB 3.75Å; F659-E1263 HydrophobicContact CE2-CG 4.12Å; F659-E1263 HydrophobicContact CG-CB 4.16Å; F659-E1263 HydrophobicContact CG-CG 3.9Å; F659-E1263 HydrophobicContact CZ-CB 3.44Å; F659-E1263 VanDerWaalsContact CZ-CB 3.44Å; F659-E1263 HydrophobicContact CZ-CG 4.21Å
660	Y	82	Confident	81.1	Confident	3 Å²	3	39.8 Å²	39.8	1%	0.012	21%	0.207	C	C	.	.			trans	-93.6	128.4	-178.6	-171.9	-98.4	0	0	0	110.2	I652 V656 G657 D658 P662 L1194 Y1252 L1260	I652-Y660 HydrophobicContact CG2-CD1 4.11Å; I652-Y660 HydrophobicContact CG2-CE1 3.71Å; V656-Y660 HydrophobicContact CB-CD1 4.2Å; V656-Y660 HydrophobicContact CB-CG 4.17Å; V656-Y660 HydrophobicContact CG1-CD1 4.18Å; V656-Y660 HydrophobicContact CG1-CD2 4.12Å; V656-Y660 HydrophobicContact CG1-CG 3.66Å; V656-Y660 HydrophobicContact CG2-CD1 4.29Å; G657-Y660 PolarHBondContact O-N 2.92Å; D658-Y660 PolarHBondContact O-N 3.37Å; Y660-P662 HydrophobicContact CD1-CG 3.94Å; Y660-P662 HydrophobicContact CE1-CB 4.32Å; Y660-P662 HydrophobicContact CE1-CG 4.11Å; Y660-P662 VanDerWaalsContact O-CD 3.28Å; Y660-P662 WeakPolarHBondContact O-CD 3.38Å; Y660-L1194 HydrophobicContact CD2-CD1 4.46Å; Y660-L1194 HydrophobicContact CE1-CD1 4.46Å; Y660-L1194 HydrophobicContact CE2-CD1 3.86Å; Y660-L1194 WeakPolarHBondContact OH-CD2 3.3Å; Y660-Y1252 VanDerWaalsContact CE2-O 3.27Å; Y660-Y1252 WeakPolarHBondContact CE2-O 3.42Å; Y660-L1260 HydrophobicContact CD2-CD2 4.07Å; Y660-L1260 HydrophobicContact CE2-CD2 4.44Å
661	H	81.5	Confident	80.2	Confident	121 Å²	121	38.9 Å²	38.9	56%	0.56	21%	0.209	S	C	*	.			trans	-107	95.3	178.2	-70.2	75	0	0	0	110.2	L663 G1253	H661-L663 PolarHBondContact O-N 3.47Å; H661-G1253 VanDerWaalsContact O-CA 3.24Å; H661-G1253 WeakPolarHBondContact O-CA 3.46Å
662	P	82.2	Confident	79.3	Confident	4 Å²	4	43.5 Å²	43.5	3%	0.026	23%	0.229	C	C	.	.			trans	-56.2	137.8	-176.1	-25.4	34.3	0	0	0	112.5	G649 I652 K653 Y660 Y664 L665 S666	G649-P662 VanDerWaalsContact O-CG 3.28Å; G649-P662 WeakPolarHBondContact O-CG 3.43Å; I652-P662 HydrophobicContact CB-CB 4.43Å; I652-P662 HydrophobicContact CB-CG 4.18Å; I652-P662 HydrophobicContact CG2-CB 4.33Å; I652-P662 HydrophobicContact CG2-CG 4.03Å; K653-P662 HydrophobicContact CB-CG 3.87Å; Y660-P662 HydrophobicContact CD1-CG 3.94Å; Y660-P662 HydrophobicContact CE1-CB 4.32Å; Y660-P662 HydrophobicContact CE1-CG 4.11Å; Y660-P662 VanDerWaalsContact O-CD 3.28Å; Y660-P662 WeakPolarHBondContact O-CD 3.38Å; P662-Y664 PolarHBondContact O-N 3.22Å; P662-L665 HydrophobicContact CB-CD1 4.43Å; P662-L665 HydrophobicContact CB-CG 4.4Å; P662-L665 HydrophobicContact CG-CD1 4.17Å; P662-L665 PolarHBondContact O-N 3.49Å; P662-S666 PolarHBondContact O-N 3.27Å
663	L	81.8	Confident	78.1	Confident	28 Å²	28	45.9 Å²	45.9	15%	0.147	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-55.1	-39.6	-179.2	-175.6	67.1	0	0	0	112	H661 L665 S666 F669 R1163 Y1251	H661-L663 PolarHBondContact O-N 3.47Å; L663-L665 PolarHBondContact O-N 2.99Å; L663-S666 VanDerWaalsContact O-CB 3.24Å; L663-S666 WeakPolarHBondContact O-CB 3.38Å; L663-S666 PolarHBondContact O-N 3.27Å; L663-S666 PolarHBondContact O-OG 3.18Å; L663-F669 HydrophobicContact CD2-CD2 4.49Å; L663-F669 HydrophobicContact CG-CD2 4.3Å; L663-F669 WeakPolarHBondContact O-CB 3.18Å; L663-R1163 VanDerWaalsContact CD2-NH2 3.33Å; L663-Y1251 HydrophobicContact CD2-CD1 4.21Å
664	Y	83.8	Confident	76.4	Confident	5 Å²	5	48.8 Å²	48.8	2%	0.02	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-63.8	-22	-179.9	-49.5	-34.8	0	0	0	113.9	L645 V648 I652 P662 F669 E1164	L645-Y664 HydrophobicContact CB-CD1 4.37Å; L645-Y664 HydrophobicContact CB-CG 4.21Å; L645-Y664 VanDerWaalsContact O-CB 3.25Å; L645-Y664 WeakPolarHBondContact O-CB 3.38Å; L645-Y664 WeakPolarHBondContact O-CD2 3.18Å; V648-Y664 HydrophobicContact CB-CD2 4.16Å; V648-Y664 HydrophobicContact CB-CE2 4.18Å; V648-Y664 HydrophobicContact CG1-CD2 4.2Å; V648-Y664 HydrophobicContact CG1-CE2 3.8Å; I652-Y664 HydrophobicContact CD1-CD2 4.14Å; I652-Y664 HydrophobicContact CD1-CE2 3.83Å; P662-Y664 PolarHBondContact O-N 3.22Å; Y664-F669 HydrophobicContact CD1-CE1 4.04Å; Y664-F669 HydrophobicContact CD1-CZ 4.06Å; Y664-E1164 VanDerWaalsContact CE1-OE2 3.23Å; Y664-E1164 WeakPolarHBondContact CE1-OE2 3.29Å; Y664-E1164 PolarHBondContact OH-OE2 3.06Å
665	L	80.8	Confident	74.4	Confident	51 Å²	51	48.7 Å²	48.7	27%	0.267	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-92.6	-8.2	175.1	-62.8	179.7	0	0	0	112.7	R646 K650 K653 P662 L663	R646-L665 HydrophobicContact CG-CD2 3.97Å; K650-L665 HydrophobicContact CG-CD2 4.17Å; K653-L665 HydrophobicContact CB-CD1 4.35Å; K653-L665 HydrophobicContact CD-CD1 4.05Å; P662-L665 HydrophobicContact CB-CD1 4.43Å; P662-L665 HydrophobicContact CB-CG 4.4Å; P662-L665 HydrophobicContact CG-CD1 4.17Å; P662-L665 PolarHBondContact O-N 3.49Å; L663-L665 PolarHBondContact O-N 2.99Å
666	S	77.2	Confident	72.1	Confident	25 Å²	25	57.3 Å²	57.3	18%	0.175	29%	0.292	C	S	.	.	S	Bend	trans	-69.7	143.6	-177.7	77.5	0	0	0	0	112.1	P662 L663 E668 F669 Q670	P662-S666 PolarHBondContact O-N 3.27Å; L663-S666 VanDerWaalsContact O-CB 3.24Å; L663-S666 WeakPolarHBondContact O-CB 3.38Å; L663-S666 PolarHBondContact O-N 3.27Å; L663-S666 PolarHBondContact O-OG 3.18Å; S666-E668 PolarHBondContact O-N 3.35Å; S666-F669 PolarHBondContact O-N 3.33Å; S666-F669 VanDerWaalsContact OG-CB 3.23Å; S666-F669 WeakPolarHBondContact OG-CB 3.08Å; S666-F669 PolarHBondContact OG-N 3.32Å; S666-F669 VanDerWaalsContact OG-N 3.07Å; S666-Q670 WeakPolarHBondContact O-CG 3.42Å; S666-Q670 PolarHBondContact O-N 2.92Å
667	K	73.9	Confident	69.6	Low	105 Å²	105	63.9 Å²	63.9	46%	0.457	32%	0.32	S	S	.	.	H	α-helix	trans	-64.3	-23.3	174.6	-66.8	178	179.5	164.5	0	112.5	A671 L918 K919	K667-A671 WeakPolarHBondContact O-CB 3.39Å; K667-A671 PolarHBondContact O-N 3.07Å; K667-L918 PolarHBondContact NZ-O 3.3Å; K667-K919 WeakPolarHBondContact CD-O 3.05Å; K667-K919 WeakPolarHBondContact CE-O 3.32Å; K667-K919 PolarHBondContact NZ-O 3.29Å
668	E	73.1	Confident	67.3	Low	93 Å²	93	73 Å²	73	44%	0.435	35%	0.346	S	S	.	.	H	α-helix	trans	-71.8	-46.5	176.5	-74.5	166.8	-170.1	0	0	110.9	S666 A671 K672 R1254	S666-E668 PolarHBondContact O-N 3.35Å; E668-A671 PolarHBondContact O-N 3.37Å; E668-K672 PolarHBondContact O-N 3.23Å; E668-K672 VanDerWaalsContact O-N 3.1Å; E668-R1254 IonicContact OE1-CZ 3.7Å; E668-R1254 IonicContact OE1-NH2 3.33Å; E668-R1254 PolarHBondContact OE1-NH2 2.81Å; E668-R1254 IonicContact OE2-NH2 2.76Å; E668-R1254 PolarHBondContact OE2-NH2 3.15Å
669	F	75.3	Confident	65.3	Low	15 Å²	15	76.1 Å²	76.1	7%	0.066	36%	0.362	C	S	.	.	H	α-helix	trans	-65.3	-44.9	174.2	-170.6	-102.4	0	0	0	111.7	I607 L645 L663 Y664 S666 A671 K672 L673 L1158	I607-F669 HydrophobicContact CD1-CE2 4.35Å; I607-F669 HydrophobicContact CD1-CZ 4.15Å; L645-F669 HydrophobicContact CB-CE1 4.41Å; L645-F669 HydrophobicContact CD1-CE1 4.04Å; L645-F669 HydrophobicContact CD1-CZ 3.71Å; L663-F669 HydrophobicContact CD2-CD2 4.49Å; L663-F669 HydrophobicContact CG-CD2 4.3Å; L663-F669 WeakPolarHBondContact O-CB 3.18Å; Y664-F669 HydrophobicContact CD1-CE1 4.04Å; Y664-F669 HydrophobicContact CD1-CZ 4.06Å; S666-F669 PolarHBondContact O-N 3.33Å; S666-F669 VanDerWaalsContact OG-CB 3.23Å; S666-F669 WeakPolarHBondContact OG-CB 3.08Å; S666-F669 PolarHBondContact OG-N 3.32Å; S666-F669 VanDerWaalsContact OG-N 3.07Å; F669-A671 VanDerWaalsContact C-N 3.26Å; F669-A671 PolarHBondContact O-N 3.19Å; F669-K672 WeakPolarHBondContact O-CA 3.25Å; F669-K672 WeakPolarHBondContact O-CB 3.13Å; F669-K672 PolarHBondContact O-N 3.4Å; F669-L673 HydrophobicContact CD1-CD1 3.55Å; F669-L673 HydrophobicContact CD2-CD1 4.47Å; F669-L673 HydrophobicContact CE1-CD1 3.31Å; F669-L673 HydrophobicContact CE2-CD1 4.26Å; F669-L673 HydrophobicContact CG-CD1 4.14Å; F669-L673 HydrophobicContact CZ-CD1 3.69Å; F669-L673 VanDerWaalsContact O-CD1 3.23Å; F669-L673 WeakPolarHBondContact O-CD1 3.28Å; F669-L673 PolarHBondContact O-N 3.45Å; F669-L673 VanDerWaalsContact O-N 3.13Å; F669-L1158 HydrophobicContact CE2-CD2 3.97Å; F669-L1158 HydrophobicContact CZ-CD2 4.43Å
670	Q	72.6	Confident	63.3	Low	49 Å²	49	80.6 Å²	80.6	23%	0.229	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-35.2	175.5	-69.4	179.2	13.7	0	0	112.6	S666 K672 L673 M674	S666-Q670 WeakPolarHBondContact O-CG 3.42Å; S666-Q670 PolarHBondContact O-N 2.92Å; Q670-K672 VanDerWaalsContact C-N 3.3Å; Q670-L673 PolarHBondContact O-N 2.65Å; Q670-M674 PolarHBondContact O-N 3.37Å
671	A	67.8	Low	60.8	Low	31 Å²	31	83 Å²	83	26%	0.256	41%	0.409	S	S	.	.	H	α-helix	trans	-69.8	-25.6	174	0	0	0	0	0	113.5	K667 E668 F669 K920	K667-A671 WeakPolarHBondContact O-CB 3.39Å; K667-A671 PolarHBondContact O-N 3.07Å; E668-A671 PolarHBondContact O-N 3.37Å; F669-A671 VanDerWaalsContact C-N 3.26Å; F669-A671 PolarHBondContact O-N 3.19Å; A671-K920 HydrophobicContact CB-CD 4.12Å; A671-K920 VanDerWaalsContact CB-CE 3.41Å
672	K	69.9	Low	58.3	Low	98 Å²	98	80.2 Å²	80.2	43%	0.426	41%	0.407	S	S	.	.	H	α-helix	trans	-72.8	-30.7	170.5	-73.4	-174.6	173.6	-168.3	0	111.9	E668 F669 Q670 D1159	E668-K672 PolarHBondContact O-N 3.23Å; E668-K672 VanDerWaalsContact O-N 3.1Å; F669-K672 WeakPolarHBondContact O-CA 3.25Å; F669-K672 WeakPolarHBondContact O-CB 3.13Å; F669-K672 PolarHBondContact O-N 3.4Å; Q670-K672 VanDerWaalsContact C-N 3.3Å; K672-D1159 IonicContact NZ-OD1 3.81Å; K672-D1159 PolarHBondContact NZ-OD1 3.31Å; K672-D1159 IonicContact NZ-OD2 2.76Å; K672-D1159 PolarHBondContact NZ-OD2 3.13Å
673	L	63.3	Low	56	Low	53 Å²	53	84.9 Å²	84.9	28%	0.277	43%	0.432	S	S	.	.	H	α-helix	trans	-80.6	-19.2	178.3	-87.8	90.3	0	0	0	114.8	I607 F669 Q670	I607-L673 HydrophobicContact CD1-CD1 3.78Å; I607-L673 HydrophobicContact CD1-CG 4.07Å; I607-L673 HydrophobicContact CG2-CD2 4.43Å; F669-L673 HydrophobicContact CD1-CD1 3.55Å; F669-L673 HydrophobicContact CD2-CD1 4.47Å; F669-L673 HydrophobicContact CE1-CD1 3.31Å; F669-L673 HydrophobicContact CE2-CD1 4.26Å; F669-L673 HydrophobicContact CG-CD1 4.14Å; F669-L673 HydrophobicContact CZ-CD1 3.69Å; F669-L673 VanDerWaalsContact O-CD1 3.23Å; F669-L673 WeakPolarHBondContact O-CD1 3.28Å; F669-L673 PolarHBondContact O-N 3.45Å; F669-L673 VanDerWaalsContact O-N 3.13Å; Q670-L673 PolarHBondContact O-N 2.65Å
674	M	52.3	Low	53.9	Low	129 Å²	129	88.1 Å²	88.1	64%	0.635	45%	0.448	S	S	*	.	S	Bend	trans	-85.2	126.8	-178.5	-74.3	-170.5	174.9	0	0	111.3	Q670 E676	Q670-M674 PolarHBondContact O-N 3.37Å; M674-E676 PolarHBondContact O-N 3.11Å
675	P	44.7	Very low	51.2	Low	54 Å²	54	92.2 Å²	92.2	35%	0.351	48%	0.476	S	S	.	.			trans	-63.4	135.3	177.5	23.7	-31.4	0	0	0	111.2	K677	P675-K677 PolarHBondContact O-N 2.91Å
676	E	38.8	Very low	49	Very low	189 Å²	189	97.7 Å²	97.7	88%	0.883	50%	0.501	S	S	*	.	S	Bend	trans	-72.9	51.2	176	-162.5	173.7	-175.9	0	0	111.6	M674	M674-E676 PolarHBondContact O-N 3.11Å
677	K	33.5	Very low	46.7	Very low	151 Å²	151	105.9 Å²	105.9	66%	0.657	53%	0.528	S	S	*	.			trans	-115.6	59.8	174	-75.7	-177.9	-176.9	166	0	110.4	P675 D1149	P675-K677 PolarHBondContact O-N 2.91Å; K677-D1149 IonicContact NZ-OD2 3.68Å; K677-D1149 PolarHBondContact NZ-OD2 2.83Å
678	R	30.4	Very low	44.7	Very low	217 Å²	217	107 Å²	107	82%	0.819	54%	0.538	S	S	*	.			trans	-155.2	49.9	163.4	-116.4	-176.7	-160.7	167	7.1	110.9
679	L	32.4	Very low	42.7	Very low	147 Å²	147	108.5 Å²	108.5	77%	0.77	55%	0.549	S	S	*	.	S	Bend	trans	-140.2	33.9	170	-132.7	90.8	0	0	0	113.2
680	E	31.5	Very low	40.5	Very low	124 Å²	124	110 Å²	110	58%	0.579	57%	0.568	S	S	*	*	S	Bend	trans	-134	-4	162.2	-70.9	-161.4	138.9	0	0	114.3	R1114	E680-R1114 IonicContact OE1-CZ 3.07Å; E680-R1114 IonicContact OE1-NE 2.72Å; E680-R1114 PolarHBondContact OE1-NE 3.12Å; E680-R1114 IonicContact OE1-NH2 2.8Å; E680-R1114 PolarHBondContact OE1-NH2 2.73Å
681	G	29.2	Very low	38.5	Very low	54 Å²	54	112.4 Å²	112.4	56%	0.557	59%	0.59	S	S	*	*	S	Bend	trans	-103.6	-6.1	173.8	0	0	0	0	0	115.4
682	A	30.4	Very low	36.6	Very low	63 Å²	63	113.6 Å²	113.6	52%	0.521	59%	0.592	S	S	.	*	H	α-helix	trans	-89.7	-7.9	-179.2	0	0	0	0	0	114.1	I684	A682-I684 PolarHBondContact O-N 3.42Å
683	D	33.8	Very low	34.6	Very low	101 Å²	101	117.1 Å²	117.1	54%	0.54	61%	0.608	S	S	.	*	H	α-helix	trans	-77.6	-6.3	169.2	-80.6	-10.5	0	0	0	112.5
684	I	37.6	Very low	32.7	Very low	97 Å²	97	122.7 Å²	122.7	50%	0.497	64%	0.637	S	S	.	*	H	α-helix	trans	-104.7	-31.5	-170.1	-61.1	172.1	0	0	0	112.1	A682 R687 L688	A682-I684 PolarHBondContact O-N 3.42Å; I684-R687 PolarHBondContact O-N 3.38Å; I684-L688 HydrophobicContact CG2-CD1 4.33Å
685	C	27.1	Very low	31.4	Very low	90 Å²	90	127.8 Å²	127.8	61%	0.608	65%	0.649	S	S	*	*	H	α-helix	trans	-83.6	-13.7	172.2	-77.8	0	0	0	0	114.1	R687	C685-R687 VanDerWaalsContact C-N 3.27Å
686	Q	33.6	Very low	30.5	Very low	167 Å²	167	130.4 Å²	130.4	78%	0.78	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-9.6	165	-115.4	177	6.5	0	0	113.1
687	R	30	Very low	29.8	Very low	196 Å²	196	126.3 Å²	126.3	74%	0.74	66%	0.661	S	S	*	*	S	Bend	trans	-96.4	-8.5	174.2	-84.9	-179.5	173.3	150.7	-0.7	114.8	I684 C685	I684-R687 PolarHBondContact O-N 3.38Å; C685-R687 VanDerWaalsContact C-N 3.27Å
688	L	31.3	Very low	29.4	Very low	129 Å²	129	127 Å²	127	68%	0.675	67%	0.667	S	S	*	*	S	Bend	trans	-112.7	8.1	-173	-72.4	167	0	0	0	115.1	I684	I684-L688 HydrophobicContact CG2-CD1 4.33Å
689	L	31.8	Very low	29.1	Very low	125 Å²	125	122.7 Å²	122.7	65%	0.654	66%	0.66	S	S	*	*	S	Bend	trans	-126.2	-34.7	179.9	-62.6	173.9	0	0	0	115.1	N873	L689-N873 PolarHBondContact O-N 3.37Å
690	G	28.1	Very low	28.8	Very low	46 Å²	46	125.3 Å²	125.3	47%	0.474	66%	0.661	S	S	.	*	S	Bend	trans	-93.8	-31.9	-167.4	0	0	0	0	0	116.6	N692	G690-N692 PolarHBondContact O-N 3.44Å
691	S	31.3	Very low	28.5	Very low	100 Å²	100	123.5 Å²	123.5	70%	0.699	66%	0.662	S	S	*	*			trans	-87.2	90	-162.9	-66.2	0	0	0	0	112.8	T874	S691-T874 WeakPolarHBondContact O-CG2 3.18Å
692	N	28.6	Very low	28.3	Very low	55 Å²	55	128 Å²	128	29%	0.294	67%	0.673	S	S	.	*			trans	-102.6	148.1	155.6	-165.3	-1	0	0	0	109.5	G690 N873 T874	G690-N692 PolarHBondContact O-N 3.44Å; N692-N873 HydrophobicContact CB-CB 3.79Å; N692-N873 VanDerWaalsContact CB-CG 3.49Å; N692-N873 WeakPolarHBondContact CB-OD1 3.38Å; N692-N873 PolarHBondContact ND2-OD1 3Å; N692-T874 HydrophobicContact CB-CG2 3.99Å
693	K	26.8	Very low	28.1	Very low	172 Å²	172	132.9 Å²	132.9	75%	0.748	69%	0.687	S	S	*	*			trans	62.7	85.7	166.6	-85.5	176.1	176.7	177.6	0	118
694	L	22.7	Very low	27.7	Very low	171 Å²	171	132.9 Å²	132.9	90%	0.895	70%	0.695	S	S	*	*				-156.9	104.2	119.9	-97	144.5	0	0	0	105
695	R	26.3	Very low	27.4	Very low	235 Å²	235	133.7 Å²	133.7	89%	0.887	71%	0.707	S	S	*	*				36.6	125	80.2	-94.7	-172.5	173.5	-158.9	-2.4	111.5
696	S	24.9	Very low	27.3	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	72%	0.716	S	S	*	*			cis	-177.8	135.3	12.1	42.7	0	0	0	0	109
697	S	24.6	Very low	26.9	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	71%	0.71	S	S	*	*			trans	169.1	110	141.8	-108.2	0	0	0	0	106.6
698	Q	24.5	Very low	26.7	Very low	165 Å²	165	126.9 Å²	126.9	77%	0.771	71%	0.708	S	S	*	*				55.8	116.5	86.7	-76	177.3	-28.5	0	0	109.9
699	D	25.2	Very low	26.4	Very low	126 Å²	126	125.2 Å²	125.2	67%	0.674	71%	0.708	S	S	*	*			cis	-159.3	160.4	21.4	-62	-52.9	0	0	0	104.7
700	Y	26.2	Very low	26.1	Very low	202 Å²	202	124.3 Å²	124.3	79%	0.792	71%	0.712	S	S	*	*			cis	-159.4	128.1	34	-84.6	-98.1	0	0	0	104.7
701	S	23.9	Very low	25.9	Very low	86 Å²	86	126.7 Å²	126.7	60%	0.601	72%	0.721	S	S	*	*				55.8	128.4	73.3	66.1	0	0	0	0	117.5
702	N	25.8	Very low	25.5	Very low	148 Å²	148	127.7 Å²	127.7	79%	0.791	72%	0.723	S	S	*	*			trans	81.4	128.5	160.9	-52.1	-19.8	0	0	0	115.3
703	M	27.1	Very low	25.4	Very low	167 Å²	167	130.1 Å²	130.1	82%	0.823	75%	0.745	S	S	*	*			cis	-162.8	120.6	35.1	-114	149.6	83	0	0	106.7
704	S	25.4	Very low	25.3	Very low	100 Å²	100	127.3 Å²	127.3	70%	0.699	75%	0.747	S	S	*	*				93.2	142.8	85.3	63.7	0	0	0	0	115.1
705	P	31.1	Very low	25.3	Very low	114 Å²	114	125 Å²	125	74%	0.74	75%	0.745	S	S	*	*			trans	-115.4	-160.2	-162.6	34.2	-12.6	0	0	0	111.6
706	S	24	Very low	25.3	Very low	115 Å²	115	118.8 Å²	118.8	80%	0.804	74%	0.738	S	S	*	*			trans	77.1	147.6	167.6	82.5	0	0	0	0	114
707	S	25.9	Very low	25.5	Very low	94 Å²	94	119.6 Å²	119.6	66%	0.657	73%	0.729	S	S	*	*			cis	-175.6	157.4	22.2	42.4	0	0	0	0	107.6
708	S	25.3	Very low	25.7	Very low	101 Å²	101	120.2 Å²	120.2	71%	0.706	72%	0.72	S	S	*	*			trans	44	134.1	136.6	66.7	0	0	0	0	119.2
709	S	25.3	Very low	25.7	Very low	94 Å²	94	119.3 Å²	119.3	66%	0.657	72%	0.721	S	S	*	*			cis	156.1	149.3	25.5	40.6	0	0	0	0	104.7
710	S	24.7	Very low	25.7	Very low	107 Å²	107	116.7 Å²	116.7	75%	0.748	72%	0.723	S	S	*	*			trans	57.6	123.8	154.8	61.2	0	0	0	0	117.2
711	S	24.3	Very low	25.6	Very low	96 Å²	96	111.1 Å²	111.1	67%	0.671	72%	0.719	S	S	*	*			cis	173.9	157.8	49.8	43.2	0	0	0	0	109
712	T	23.9	Very low	25.6	Very low	121 Å²	121	114.7 Å²	114.7	74%	0.742	73%	0.73	S	S	*	*			trans	68.3	118.2	147.4	49.2	0	0	0	0	120.6
713	S	25.1	Very low	25.9	Very low	106 Å²	106	112.9 Å²	112.9	74%	0.741	73%	0.727	S	S	*	*	S	Bend	trans	68.2	136.8	148.2	63.6	0	0	0	0	119.1
714	S	24.4	Very low	26.1	Very low	113 Å²	113	108.3 Å²	108.3	79%	0.79	71%	0.71	S	S	*	*			trans	67.1	-177.9	173	80.5	0	0	0	0	115.6
715	S	24.1	Very low	26.3	Very low	123 Å²	123	112 Å²	112	86%	0.86	71%	0.708	S	S	*	*			trans	68.7	-167.7	-165	84.6	0	0	0	0	114.6
716	S	25.2	Very low	26.3	Very low	104 Å²	104	109 Å²	109	73%	0.727	69%	0.688	S	S	*	*			trans	-166.7	173.3	-159.6	60.9	0	0	0	0	115.3
717	H	28.7	Very low	26.6	Very low	125 Å²	125	110 Å²	110	58%	0.579	68%	0.684	S	S	*	*			trans	85.8	134	169.8	-97.3	-81.4	0	0	0	119.7	T383	T383-H717 WeakPolarHBondContact CG2-CE1 3.46Å; T383-H717 VanDerWaalsContact CG2-NE2 3.34Å; T383-H717 WeakPolarHBondContact CG2-NE2 3.43Å
718	H	29.1	Very low	26.9	Very low	117 Å²	117	108.2 Å²	108.2	54%	0.542	68%	0.681	S	S	.	*			trans	78.6	133.4	150.6	-93.7	-60.4	0	0	0	122.4
719	N	25.1	Very low	27.1	Very low	147 Å²	147	110.2 Å²	110.2	79%	0.786	68%	0.683	S	S	*	*			trans	83.4	118.2	146	-64.2	-15.5	0	0	0	117.8
720	G	25	Very low	27.3	Very low	71 Å²	71	113.5 Å²	113.5	73%	0.732	69%	0.685	S	S	*	*			trans	127	99.7	134.1	0	0	0	0	0	114.3
721	A	24.3	Very low	27.5	Very low	84 Å²	84	114.1 Å²	114.1	69%	0.694	68%	0.68	S	S	*	*				96.5	135.3	108.3	0	0	0	0	0	117.9
722	I	23.8	Very low	27.6	Very low	162 Å²	162	113.9 Å²	113.9	83%	0.831	67%	0.671	S	S	*	*			trans	95	101.3	135.7	-64.6	150.8	0	0	0	117.8
723	C	31.6	Very low	27.8	Very low	109 Å²	109	113.9 Å²	113.9	74%	0.736	67%	0.671	S	S	*	*			trans	-56.4	166.7	149.4	-65.3	0	0	0	0	112
724	P	31.3	Very low	27.6	Very low	72 Å²	72	116.1 Å²	116.1	47%	0.468	66%	0.663	S	S	.	*				-153.5	160.4	96.9	31.5	-10.6	0	0	0	116.2
725	R	29.2	Very low	27.5	Very low	176 Å²	176	116.7 Å²	116.7	66%	0.664	65%	0.652	S	S	*	*			trans	-151.7	92	-177.7	-154.7	94.6	-43.6	-145.8	2.6	116	L752 T753 S754	R725-L752 CarbonylContact C-O 3.58Å; R725-T753 CarbonylContact C-O 3.55Å; R725-T753 PolarHBondContact N-O 2.71Å; R725-T753 CarbonylContact O-C 3.33Å; R725-T753 PolarHBondContact O-OG1 2.88Å; R725-S754 WeakPolarHBondContact O-CB 2.93Å; R725-S754 PolarHBondContact O-N 3.35Å
726	T	32.3	Very low	27.6	Very low	52 Å²	52	113.6 Å²	113.6	32%	0.319	63%	0.625	S	S	.	*			trans	-105	174.9	161.6	-4	0	0	0	0	109.2	H751 L752 T753	T726-H751 WeakPolarHBondContact CB-ND1 3.23Å; T726-H751 WeakPolarHBondContact CG2-ND1 3.47Å; T726-H751 PolarHBondContact OG1-ND1 3.25Å; T726-L752 WeakPolarHBondContact CB-O 3.38Å; T726-L752 PolarHBondContact N-O 2.9Å; T726-L752 PolarHBondContact OG1-O 2.88Å; T726-T753 WeakPolarHBondContact CA-OG1 3.1Å; T726-T753 HydrophobicContact CG2-CG2 3.93Å; T726-T753 WeakPolarHBondContact CG2-OG1 3.48Å
727	L	30.5	Very low	27.5	Very low	135 Å²	135	112.5 Å²	112.5	71%	0.707	61%	0.611	S	S	*	*			cis	-150.4	158.6	23.5	-82.9	97.9	0	0	0	107.9	L729	L727-L729 HydrophobicContact CD2-CD1 4.46Å
728	G	30.8	Very low	27.5	Very low	58 Å²	58	109.2 Å²	109.2	60%	0.598	59%	0.594	S	S	*	*			cis	144.4	156.9	8.2	0	0	0	0	0	111
729	L	30.9	Very low	27.3	Very low	143 Å²	143	107 Å²	107	75%	0.749	59%	0.586	S	S	*	*			trans	73	139.1	157.7	-77.8	78.9	0	0	0	115.5	L727	L727-L729 HydrophobicContact CD2-CD1 4.46Å
730	K	29.7	Very low	27.3	Very low	162 Å²	162	104.8 Å²	104.8	70%	0.704	57%	0.571	S	S	*	*			cis	-173.5	136.9	27.3	-123.4	171.8	171.9	-179.8	0	102.9
731	D	29.2	Very low	27.3	Very low	120 Å²	120	103.7 Å²	103.7	64%	0.642	55%	0.549	S	S	*	.				-177	125.2	60	-92.1	-48.3	0	0	0	105.6
732	N	24.6	Very low	27.4	Very low	91 Å²	91	107 Å²	107	49%	0.487	54%	0.544	S	S	.	.				57.5	90.7	92.1	-66.3	-44.8	0	0	0	115.1	R734	N732-R734 HydrophobicContact CB-CG 4.47Å; N732-R734 VanDerWaalsContact OD1-CZ 3.29Å; N732-R734 PolarHBondContact OD1-NE 2.73Å; N732-R734 PolarHBondContact OD1-NH2 3Å
733	V	28.1	Very low	27.5	Very low	122 Å²	122	103.7 Å²	103.7	74%	0.739	53%	0.528	S	S	*	.			trans	-155.2	115.1	135.5	-177	0	0	0	0	108.3	P846	V733-P846 HydrophobicContact CG1-CG 3.85Å
734	R	22.1	Very low	27.3	Very low	152 Å²	152	104 Å²	104	57%	0.574	52%	0.522	S	S	*	.			cis	104.4	60.1	11.7	-55.1	-167.5	175.3	-93.8	-3.7	119.8	N732	N732-R734 HydrophobicContact CB-CG 4.47Å; N732-R734 VanDerWaalsContact OD1-CZ 3.29Å; N732-R734 PolarHBondContact OD1-NE 2.73Å; N732-R734 PolarHBondContact OD1-NH2 3Å
735	F	21.4	Very low	27	Very low	125 Å²	125	107.4 Å²	107.4	55%	0.548	53%	0.533	S	S	.	.				67.4	172.9	122.1	-49.3	-47.5	0	0	0	121.5	D737 R847	F735-D737 WeakPolarHBondContact CA-OD2 3.31Å; F735-D737 WeakPolarHBondContact CB-OD2 3.2Å; F735-R847 PolarHBondContact O-NH2 3.48Å
736	I	26.5	Very low	26.7	Very low	58 Å²	58	105.3 Å²	105.3	30%	0.297	54%	0.535	S	S	.	.			trans	59.7	89.4	-167.8	-49	-175	0	0	0	108.8	Y738 R847	I736-Y738 HydrophobicContact CB-CD1 4.32Å; I736-Y738 HydrophobicContact CB-CG 4.46Å; I736-Y738 HydrophobicContact CD1-CD1 4.13Å; I736-Y738 HydrophobicContact CD1-CE1 3.77Å; I736-Y738 HydrophobicContact CG1-CD1 3.88Å; I736-Y738 HydrophobicContact CG1-CE1 3.6Å; I736-Y738 HydrophobicContact CG1-CE2 4.31Å; I736-Y738 HydrophobicContact CG1-CG 4.35Å; I736-Y738 HydrophobicContact CG2-CD1 3.84Å; I736-Y738 HydrophobicContact CG2-CE1 4.45Å; I736-Y738 HydrophobicContact CG2-CG 4Å; I736-R847 VanDerWaalsContact O-CA 3.24Å; I736-R847 WeakPolarHBondContact O-CA 3.23Å; I736-R847 PolarHBondContact O-N 3.03Å; I736-R847 PolarHBondContact O-NE 3.41Å
737	D	23.8	Very low	26.3	Very low	82 Å²	82	108.9 Å²	108.9	44%	0.439	55%	0.552	S	S	.	*			cis	68.4	-154.7	18.5	-33.4	-40.1	0	0	0	113	F735 S848 S849	F735-D737 WeakPolarHBondContact CA-OD2 3.31Å; F735-D737 WeakPolarHBondContact CB-OD2 3.2Å; D737-S848 WeakPolarHBondContact CA-OG 3.47Å; D737-S848 PolarHBondContact N-OG 2.9Å; D737-S848 PolarHBondContact O-OG 3.38Å; D737-S849 PolarHBondContact O-OG 3.39Å; D737-S849 VanDerWaalsContact O-OG 3.13Å
738	Y	28.6	Very low	26.1	Very low	56 Å²	56	108.9 Å²	108.9	22%	0.22	55%	0.552	C	S	.	*			trans	72.9	161.6	166.3	-67.4	-170.6	0	0	0	114.1	I736 E740 S849 R907	I736-Y738 HydrophobicContact CB-CD1 4.32Å; I736-Y738 HydrophobicContact CB-CG 4.46Å; I736-Y738 HydrophobicContact CD1-CD1 4.13Å; I736-Y738 HydrophobicContact CD1-CE1 3.77Å; I736-Y738 HydrophobicContact CG1-CD1 3.88Å; I736-Y738 HydrophobicContact CG1-CE1 3.6Å; I736-Y738 HydrophobicContact CG1-CE2 4.31Å; I736-Y738 HydrophobicContact CG1-CG 4.35Å; I736-Y738 HydrophobicContact CG2-CD1 3.84Å; I736-Y738 HydrophobicContact CG2-CE1 4.45Å; I736-Y738 HydrophobicContact CG2-CG 4Å; Y738-E740 HydrophobicContact CD1-CG 3.64Å; Y738-E740 HydrophobicContact CE1-CG 4.5Å; Y738-E740 HydrophobicContact CG-CG 4.09Å; Y738-S849 PolarHBondContact O-OG 3.06Å; Y738-R907 WeakPolarHBondContact OH-CD 3.4Å; Y738-R907 VanDerWaalsContact OH-CZ 3.3Å; Y738-R907 PolarHBondContact OH-NE 3.04Å; Y738-R907 PolarHBondContact OH-NH1 2.88Å
739	N	24.2	Very low	25.8	Very low	71 Å²	71	111 Å²	111	38%	0.38	56%	0.558	S	S	.	*	S	Bend	cis	-133.4	135.4	39.2	-95.8	31.9	0	0	0	115.1	H909	N739-H909 PolarHBondContact O-CD2 2.77Å; N739-H909 PolarHBondContact O-CE1 3.38Å; N739-H909 PolarHBondContact O-NE2 2.82Å
740	E	26.1	Very low	25.5	Very low	100 Å²	100	112.1 Å²	112.1	47%	0.467	56%	0.564	S	S	.	*			cis	-177.4	158.3	-3.2	-136	159.1	-156.6	0	0	114.6	Y738 H909	Y738-E740 HydrophobicContact CD1-CG 3.64Å; Y738-E740 HydrophobicContact CE1-CG 4.5Å; Y738-E740 HydrophobicContact CG-CG 4.09Å; E740-H909 PolarHBondContact N-CD2 2.82Å; E740-H909 PolarHBondContact N-NE2 3.34Å
741	D	24.9	Very low	25.4	Very low	48 Å²	48	110 Å²	110	26%	0.257	56%	0.556	S	S	.	*			trans	51.5	160	159.4	-96.9	50.6	0	0	0	121.9	R907 P908	D741-R907 VanDerWaalsContact CG-NH2 3.29Å; D741-R907 IonicContact OD1-CZ 3.93Å; D741-R907 IonicContact OD1-NE 3.82Å; D741-R907 PolarHBondContact OD1-NE 3.07Å; D741-R907 IonicContact OD1-NH2 2.82Å; D741-R907 PolarHBondContact OD1-NH2 3.19Å; D741-R907 IonicContact OD2-CZ 2.7Å; D741-R907 IonicContact OD2-NH2 2.77Å; D741-R907 PolarHBondContact OD2-NH2 3.33Å; D741-R907 VanDerWaalsContact OD2-NH2 3.09Å; D741-P908 WeakPolarHBondContact O-CD 3.09Å
742	Y	25.2	Very low	25.3	Very low	154 Å²	154	110.6 Å²	110.6	60%	0.604	56%	0.558	S	S	*	*			cis	-124.7	158.1	21.2	-62.7	-85.5	0	0	0	115.3	S906 R907	Y742-S906 PolarHBondContact N-O 3.38Å; Y742-S906 CarbonylContact O-C 3.6Å; Y742-S906 WeakPolarHBondContact O-CA 3.21Å; Y742-R907 WeakPolarHBondContact O-CB 3.33Å; Y742-R907 PolarHBondContact O-N 2.84Å
743	D	27	Very low	25.5	Very low	91 Å²	91	110.6 Å²	110.6	49%	0.487	56%	0.562	S	S	.	*			trans	-56.9	-102.6	-157.1	-157.9	-110.5	0	0	0	119.6	M745 R907	D743-M745 PolarHBondContact OD1-N 3.33Å; D743-R907 IonicContact OD2-CZ 2.87Å; D743-R907 IonicContact OD2-NH1 2.71Å; D743-R907 PolarHBondContact OD2-NH1 2.87Å; D743-R907 IonicContact OD2-NH2 2.61Å; D743-R907 PolarHBondContact OD2-NH2 2.96Å
744	L	26.2	Very low	25.8	Very low	117 Å²	117	108.5 Å²	108.5	61%	0.613	55%	0.553	S	S	*	*			cis	-144.3	124.5	-11.7	-132.7	114.8	0	0	0	109
745	M	24.9	Very low	26	Very low	142 Å²	142	107.1 Å²	107.1	70%	0.7	56%	0.563	S	S	*	*			trans	62.2	135	138.5	-65.8	-170.6	-169.4	0	0	123.6	D743	D743-M745 PolarHBondContact OD1-N 3.33Å
746	N	24.7	Very low	26.4	Very low	132 Å²	132	104.1 Å²	104.1	71%	0.706	56%	0.556	S	S	*	*			trans	99.9	111.7	132.7	-79.1	-9.7	0	0	0	122.9
747	L	23.6	Very low	26.5	Very low	128 Å²	128	104.8 Å²	104.8	67%	0.67	57%	0.565	S	S	*	*				73.8	117.3	127.2	-88	85.5	0	0	0	121.9
748	N	24.8	Very low	26.9	Very low	135 Å²	135	106 Å²	106	72%	0.722	58%	0.577	S	S	*	*				80.1	114.5	129.3	-66	-5	0	0	0	121.2
749	S	24.3	Very low	27.3	Very low	102 Å²	102	109.9 Å²	109.9	71%	0.713	60%	0.601	S	S	*	*			trans	109.8	124.3	132.8	-52.6	0	0	0	0	119.4
750	L	24.9	Very low	27.7	Very low	167 Å²	167	110.6 Å²	110.6	87%	0.874	61%	0.61	S	S	*	*			trans	85.7	140.3	149.2	-63.4	141.9	0	0	0	118.6
751	H	27.7	Very low	28.4	Very low	117 Å²	117	111 Å²	111	54%	0.542	62%	0.621	S	S	.	*			trans	-120.8	161.3	-138.5	-109.8	-128.8	0	0	0	118.9	T726	T726-H751 WeakPolarHBondContact CB-ND1 3.23Å; T726-H751 WeakPolarHBondContact CG2-ND1 3.47Å; T726-H751 PolarHBondContact OG1-ND1 3.25Å
752	L	27.3	Very low	28.5	Very low	132 Å²	132	112.3 Å²	112.3	69%	0.691	63%	0.632	S	S	*	*			trans	-139.6	-136.9	-174.8	-59.6	174.4	0	0	0	114.2	R725 T726	R725-L752 CarbonylContact C-O 3.58Å; T726-L752 WeakPolarHBondContact CB-O 3.38Å; T726-L752 PolarHBondContact N-O 2.9Å; T726-L752 PolarHBondContact OG1-O 2.88Å
753	T	30	Very low	28.4	Very low	91 Å²	91	108.5 Å²	108.5	56%	0.558	63%	0.626	S	S	*	*			trans	66.7	176.8	-175.9	85.3	0	0	0	0	115.1	R725 T726	R725-T753 CarbonylContact C-O 3.55Å; R725-T753 PolarHBondContact N-O 2.71Å; R725-T753 CarbonylContact O-C 3.33Å; R725-T753 PolarHBondContact O-OG1 2.88Å; T726-T753 WeakPolarHBondContact CA-OG1 3.1Å; T726-T753 HydrophobicContact CG2-CG2 3.93Å; T726-T753 WeakPolarHBondContact CG2-OG1 3.48Å
754	S	32.8	Very low	28.3	Very low	79 Å²	79	110 Å²	110	55%	0.552	64%	0.64	S	S	*	*			cis	-121.3	146	17.2	55.5	0	0	0	0	114	R725	R725-S754 WeakPolarHBondContact O-CB 2.93Å; R725-S754 PolarHBondContact O-N 3.35Å
755	P	26.9	Very low	28.3	Very low	122 Å²	122	109.8 Å²	109.8	79%	0.792	64%	0.644	S	S	*	*				-141.4	161.8	110.4	37.1	-22.9	0	0	0	113.1
756	P	30.2	Very low	28.3	Very low	62 Å²	62	107.7 Å²	107.7	40%	0.403	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-92	165.9	-172	36.1	-36.2	0	0	0	115.7	T280	T280-P756 WeakPolarHBondContact O-CG 3.34Å; T280-P756 WeakPolarHBondContact OG1-CD 3.26Å; T280-P756 WeakPolarHBondContact OG1-CG 3.35Å
757	P	27.9	Very low	28.3	Very low	72 Å²	72	107.1 Å²	107.1	47%	0.468	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-97.3	158.7	-175.5	37.9	-36.4	0	0	0	115.8	Q283	Q283-P757 PolarHBondContact NE2-O 2.68Å
758	P	32.3	Very low	28.4	Very low	107 Å²	107	106 Å²	106	70%	0.695	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-89.7	167.2	176.5	37	-36.3	0	0	0	114.7	Q283	Q283-P758 VanDerWaalsContact NE2-CA 3.29Å
759	L	36.9	Very low	28.4	Very low	138 Å²	138	105.2 Å²	105.2	72%	0.723	64%	0.644	S	S	*	*			trans	68.7	150.4	179.3	-66	150	0	0	0	116.1	Q283	Q283-L759 VanDerWaalsContact CD-C 3.45Å; Q283-L759 VanDerWaalsContact NE2-N 3.1Å; Q283-L759 PolarHBondContact NE2-O 3.21Å; Q283-L759 PolarHBondContact OE1-O 2.99Å
760	P	32.4	Very low	28.5	Very low	87 Å²	87	105 Å²	105	57%	0.565	64%	0.638	S	S	*	*			cis	-124.9	174.7	1.3	42	-28.6	0	0	0	114.6
761	P	41.4	Very low	28.7	Very low	109 Å²	109	102.5 Å²	102.5	71%	0.708	62%	0.624	S	S	*	*			trans	-104.2	135.2	168	36	-28.3	0	0	0	113.7
762	P	26.8	Very low	28.7	Very low	74 Å²	74	99.8 Å²	99.8	48%	0.481	61%	0.612	S	S	.	*			trans	-126.9	169.6	171.4	38.3	-24.4	0	0	0	114.2
763	P	24.1	Very low	28.6	Very low	75 Å²	75	100.6 Å²	100.6	49%	0.487	61%	0.612	S	S	.	*			cis	-83.4	-70.8	-8.2	13.9	-0.4	0	0	0	112.7
764	P	24.7	Very low	28.5	Very low	121 Å²	121	103.3 Å²	103.3	79%	0.786	62%	0.622	S	S	*	*			cis	-77.3	147.3	-23.4	35.3	-34.2	0	0	0	111.6
765	T	25.9	Very low	28.1	Very low	114 Å²	114	102.2 Å²	102.2	70%	0.699	62%	0.623	S	S	*	*			trans	-162.8	145.5	-174.2	-64.2	0	0	0	0	110.1
766	S	25.7	Very low	28	Very low	98 Å²	98	104.5 Å²	104.5	69%	0.685	62%	0.621	S	S	*	*			trans	57.6	120.4	165.6	65.1	0	0	0	0	115
767	T	23.7	Very low	27.7	Very low	119 Å²	119	111.3 Å²	111.3	73%	0.73	64%	0.639	S	S	*	*			cis	177.3	145	46.2	-16.4	0	0	0	0	100.8
768	T	25.6	Very low	27.6	Very low	104 Å²	104	115.5 Å²	115.5	64%	0.638	66%	0.657	S	S	*	*			cis	179.9	118.6	43.8	-17.3	0	0	0	0	100.8
769	T	24.8	Very low	27.7	Very low	119 Å²	119	115.8 Å²	115.8	73%	0.73	66%	0.659	S	S	*	*				84.9	96.9	111.5	57.8	0	0	0	0	114
770	V	25.9	Very low	27.1	Very low	98 Å²	98	113.5 Å²	113.5	59%	0.594	66%	0.66	S	S	*	*			trans	-165.5	127.3	176.1	137.1	0	0	0	0	103.6
771	I	29.6	Very low	26.7	Very low	114 Å²	114	117.7 Å²	117.7	59%	0.585	67%	0.67	S	S	*	*			cis	68.9	122.6	1.8	-46.6	176.5	0	0	0	113.4
772	E	27.6	Very low	25.9	Very low	60 Å²	60	118.5 Å²	118.5	28%	0.28	67%	0.668	S	S	.	*			cis	-68.4	157.1	0.9	-60.8	151	175.8	0	0	112.2	I300 S301 T302	I300-E772 VanDerWaalsContact C-OE2 3.26Å; I300-E772 HydrophobicContact CB-CB 4.27Å; I300-E772 WeakPolarHBondContact CB-OE2 3.36Å; I300-E772 VanDerWaalsContact CG2-OE2 3.3Å; I300-E772 WeakPolarHBondContact CG2-OE2 3.41Å; I300-E772 PolarHBondContact O-N 3.38Å; I300-E772 VanDerWaalsContact O-N 3.12Å; S301-E772 WeakPolarHBondContact CA-OE1 3.48Å; S301-E772 PolarHBondContact N-OE2 3.35Å; T302-E772 WeakPolarHBondContact CG2-OE1 3.28Å; T302-E772 PolarHBondContact N-OE1 2.84Å; T302-E772 PolarHBondContact OG1-OE1 2.86Å
773	E	25.4	Very low	25.7	Very low	149 Å²	149	123.1 Å²	123.1	70%	0.696	68%	0.682	S	S	*	*			cis	85.6	124.2	23.7	-85.3	-163.1	165.5	0	0	114
774	I	27.2	Very low	25.6	Very low	148 Å²	148	124.5 Å²	124.5	76%	0.759	69%	0.693	S	S	*	*			cis	-163.7	148.3	27.2	-86.2	134.5	0	0	0	110
775	G	25.6	Very low	25.5	Very low	57 Å²	57	124.2 Å²	124.2	59%	0.588	69%	0.685	S	S	*	*			trans	125	71.9	147.2	0	0	0	0	0	117
776	F	23.9	Very low	25.3	Very low	169 Å²	169	126.5 Å²	126.5	74%	0.741	69%	0.685	S	S	*	*				64.9	134.9	101.2	-83	-118.5	0	0	0	115.3
777	R	23.5	Very low	25.2	Very low	206 Å²	206	129.2 Å²	129.2	78%	0.777	68%	0.681	S	S	*	*			cis	-178.3	144.4	4.2	-117.5	-172.6	-167.9	-172.9	2.8	107.5
778	N	25.9	Very low	25.1	Very low	160 Å²	160	126.4 Å²	126.4	86%	0.856	68%	0.676	S	S	*	*			trans	-174.8	-179.8	170.4	-120.2	-100.5	0	0	0	110.2
779	P	34.8	Very low	25	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	67%	0.674	S	S	*	*			cis	-128.8	172.4	-16	41.5	-27	0	0	0	114.8
780	A	25.4	Very low	24.9	Very low	90 Å²	90	127 Å²	127	74%	0.744	66%	0.664	S	S	*	*			trans	-169.3	149.5	167.1	0	0	0	0	0	111.2
781	F	24.2	Very low	24.8	Very low	174 Å²	174	125.7 Å²	125.7	76%	0.763	66%	0.663	S	S	*	*			cis	-168.4	130.5	5.4	-124.8	-120.2	0	0	0	104.6
782	L	23.6	Very low	24.5	Very low	127 Å²	127	124.3 Å²	124.3	67%	0.665	66%	0.656	S	S	*	*				89.1	133.9	101.4	-120.7	89.4	0	0	0	116.9
783	E	21.6	Very low	24.5	Very low	170 Å²	170	129.1 Å²	129.1	79%	0.794	68%	0.682	S	S	*	*			trans	90	139.5	149.7	-98.2	170.7	172.8	0	0	122.6
784	C	22.7	Very low	24.5	Very low	104 Å²	104	127.7 Å²	127.7	70%	0.703	67%	0.67	S	S	*	*			trans	84.2	104	156.4	-77.1	0	0	0	0	120.5
785	D	22.4	Very low	24.5	Very low	116 Å²	116	132.5 Å²	132.5	62%	0.62	68%	0.679	S	S	*	*				89.8	102.4	129.2	-79.7	-47.8	0	0	0	119
786	K	22.2	Very low	24.4	Very low	162 Å²	162	132.7 Å²	132.7	70%	0.704	68%	0.681	S	S	*	*				60.4	109	124.9	-73.5	-170.2	-166.7	91	0	116.4
787	Y	22.8	Very low	24.5	Very low	155 Å²	155	128.6 Å²	128.6	61%	0.608	68%	0.678	S	S	*	*			trans	77.8	110.5	153.6	-67.2	-128.7	0	0	0	117.3	R1444	Y787-R1444 HydrophobicContact CD1-CG 3.76Å; Y787-R1444 HydrophobicContact CE1-CB 3.93Å; Y787-R1444 HydrophobicContact CE1-CG 3.39Å
788	G	22.9	Very low	24.5	Very low	60 Å²	60	125.2 Å²	125.2	62%	0.619	68%	0.681	S	S	*	*			trans	87.7	174.5	159.9	0	0	0	0	0	115.6
789	T	22.3	Very low	24.4	Very low	98 Å²	98	122.5 Å²	122.5	60%	0.601	68%	0.675	S	S	*	*			cis	-157.8	147.2	-24.6	-59.9	0	0	0	0	108.5	R997	T789-R997 PolarHBondContact OG1-NH2 3.18Å
790	R	23.1	Very low	23.8	Very low	138 Å²	138	122.4 Å²	122.4	52%	0.521	67%	0.671	S	S	.	*			trans	65	-154.4	-175.2	-143.2	-175.8	171.3	79	11.6	110	L1000 Y1002 D1003	R790-L1000 PolarHBondContact NH1-O 3.44Å; R790-Y1002 WeakPolarHBondContact CD-O 3.26Å; R790-Y1002 PolarHBondContact NE-O 3Å; R790-D1003 IonicContact CZ-OD1 2.64Å; R790-D1003 VanDerWaalsContact CZ-OD1 3.24Å; R790-D1003 IonicContact CZ-OD2 3.6Å; R790-D1003 VanDerWaalsContact NE-CG 3.25Å; R790-D1003 IonicContact NE-OD1 2.94Å; R790-D1003 PolarHBondContact NE-OD1 2.64Å; R790-D1003 VanDerWaalsContact NE-OD1 3.1Å; R790-D1003 IonicContact NE-OD2 2.91Å; R790-D1003 PolarHBondContact NE-OD2 3.47Å; R790-D1003 IonicContact NH2-OD1 2.77Å; R790-D1003 PolarHBondContact NH2-OD1 2.89Å; R790-D1003 IonicContact NH2-OD2 3.87Å
791	A	23.9	Very low	23.9	Very low	69 Å²	69	126.4 Å²	126.4	57%	0.57	68%	0.675	S	S	*	*			cis	-173.6	145.3	2.6	0	0	0	0	0	105.5
792	I	24.2	Very low	24	Very low	86 Å²	86	123.4 Å²	123.4	44%	0.441	67%	0.673	S	S	.	*			cis	-170.2	142.6	36.2	-91.1	142.5	0	0	0	108.9	D1003 A1004	I792-D1003 HydrophobicContact CB-CB 4.47Å; I792-D1003 HydrophobicContact CG1-CB 3.68Å; I792-D1003 VanDerWaalsContact CG1-OD2 3.23Å; I792-D1003 WeakPolarHBondContact CG1-OD2 3.39Å; I792-D1003 HydrophobicContact CG2-CB 4.26Å; I792-A1004 HydrophobicContact CD1-CB 3.87Å
793	I	27.5	Very low	24	Very low	160 Å²	160	121.2 Å²	121.2	82%	0.821	67%	0.673	S	S	*	*			trans	-140.8	131.5	149	-56.7	178.8	0	0	0	105.8
794	R	25.6	Very low	24.2	Very low	119 Å²	119	120.4 Å²	120.4	45%	0.449	67%	0.669	S	S	.	*			trans	-144.1	40.9	-177.1	-146.1	-166.9	-152.6	178.4	-5.9	116.3	G796 A1001 Y1002 D1003	R794-G796 WeakPolarHBondContact O-CA 3.49Å; R794-G796 PolarHBondContact O-N 2.84Å; R794-A1001 PolarHBondContact NH2-O 2.7Å; R794-Y1002 VanDerWaalsContact NH2-CD2 3.35Å; R794-D1003 HydrophobicContact CB-CB 3.8Å; R794-D1003 WeakPolarHBondContact CD-O 3.16Å; R794-D1003 HydrophobicContact CG-CB 3.75Å; R794-D1003 PolarHBondContact NH1-O 2.6Å
795	R	26.4	Very low	24.4	Very low	249 Å²	249	123.7 Å²	123.7	94%	0.94	67%	0.671	S	S	*	*			trans	-82.2	101.3	158.4	-81.8	-171.8	177.2	171.6	-1	107.4
796	G	24.8	Very low	24.8	Very low	62 Å²	62	125.3 Å²	125.3	64%	0.639	68%	0.68	S	S	*	*			cis	72.8	88.7	18.6	0	0	0	0	0	109.5	R794	R794-G796 WeakPolarHBondContact O-CA 3.49Å; R794-G796 PolarHBondContact O-N 2.84Å
797	A	24	Very low	25.9	Very low	82 Å²	82	125.1 Å²	125.1	68%	0.678	69%	0.687	S	S	*	*			trans	-175.2	119.2	147.1	0	0	0	0	0	108.2
798	T	24.2	Very low	26.2	Very low	136 Å²	136	121.1 Å²	121.1	83%	0.834	69%	0.692	S	S	*	*			trans	65.2	130.4	134.4	64.8	0	0	0	0	117.4
799	S	25.1	Very low	26.3	Very low	103 Å²	103	125.2 Å²	125.2	72%	0.72	70%	0.7	S	S	*	*			cis	-167.4	128.3	16.8	-154.9	0	0	0	0	103.5
800	V	21.9	Very low	26.5	Very low	110 Å²	110	127.3 Å²	127.3	67%	0.667	71%	0.708	S	S	*	*				50.5	101.3	62.3	-177.5	0	0	0	0	111.1
801	E	26.7	Very low	26.8	Very low	175 Å²	175	126.7 Å²	126.7	82%	0.818	72%	0.715	S	S	*	*			trans	55.4	172.3	138.7	-60.3	178.8	149.1	0	0	118.7
802	P	26.1	Very low	27.1	Very low	111 Å²	111	129.8 Å²	129.8	72%	0.721	72%	0.722	S	S	*	*			cis	-120.3	161.1	-15.4	13.8	12.8	0	0	0	110.4
803	A	24.5	Very low	27.5	Very low	80 Å²	80	131.6 Å²	131.6	66%	0.661	73%	0.732	S	S	*	*				51.1	132.2	102.8	0	0	0	0	0	117.2
804	E	25.2	Very low	27.7	Very low	154 Å²	154	129.8 Å²	129.8	72%	0.72	72%	0.724	S	S	*	*			trans	86.8	143.2	147.6	-57.9	-178.5	148	0	0	119.6
805	K	27.3	Very low	27.9	Very low	172 Å²	172	130.4 Å²	130.4	75%	0.748	74%	0.737	S	S	*	*			cis	-136.1	-106.3	9.9	-126.5	144	-161.3	149.1	0	116.1
806	N	29.3	Very low	28.1	Very low	151 Å²	151	122.4 Å²	122.4	81%	0.807	71%	0.712	S	S	*	*			trans	-157.2	163.8	-162.9	-158	92.7	0	0	0	114.3
807	D	45.6	Very low	28.4	Very low	158 Å²	158	127.4 Å²	127.4	85%	0.845	71%	0.713	S	S	*	*	S	Bend	trans	-59.8	141.6	163.8	-71.5	-48.5	0	0	0	113.4
808	G	29.7	Very low	28.6	Very low	70 Å²	70	126.4 Å²	126.4	72%	0.722	70%	0.696	S	S	*	*			trans	93.4	113.5	168.3	0	0	0	0	0	115.4
809	D	24.4	Very low	28.7	Very low	147 Å²	147	122.3 Å²	122.3	79%	0.786	67%	0.671	S	S	*	*			cis	-147.8	156.9	16.6	-81.1	-32.6	0	0	0	109
810	N	27.7	Very low	28.8	Very low	141 Å²	141	122.3 Å²	122.3	75%	0.754	66%	0.663	S	S	*	*			trans	71	137	158.1	-59.1	-10.6	0	0	0	116
811	D	29.2	Very low	29.2	Very low	125 Å²	125	122.5 Å²	122.5	67%	0.668	66%	0.66	S	S	*	*			cis	-159	143.9	13.4	-82.1	-33.3	0	0	0	104
812	D	30.8	Very low	29.3	Very low	135 Å²	135	119 Å²	119	72%	0.722	64%	0.64	S	S	*	*				41.6	125.7	92.9	-58.8	-20.9	0	0	0	110.6
813	D	31.9	Very low	29.4	Very low	124 Å²	124	121 Å²	121	66%	0.663	64%	0.639	S	S	*	*			cis	165	163.2	36.9	-110	-24.2	0	0	0	104.5
814	D	31.2	Very low	29.6	Very low	122 Å²	122	122.3 Å²	122.3	65%	0.652	64%	0.635	S	S	*	*			trans	60.6	115.5	137.7	-62.5	-27.4	0	0	0	122
815	N	30.2	Very low	29.9	Very low	132 Å²	132	122.5 Å²	122.5	71%	0.706	64%	0.636	S	S	*	*				81.8	126.4	90.4	-70.8	-48.7	0	0	0	116.8
816	D	31	Very low	30	Very low	80 Å²	80	121 Å²	121	43%	0.428	64%	0.636	S	S	.	*			trans	66.7	172.7	173.7	-76.1	-16.8	0	0	0	118.5	R317	R317-D816 WeakPolarHBondContact CD-OD1 3.45Å; R317-D816 IonicContact CZ-OD1 2.75Å; R317-D816 IonicContact CZ-OD2 3.72Å; R317-D816 IonicContact NE-OD1 2.89Å; R317-D816 IonicContact NH1-OD1 3.19Å; R317-D816 PolarHBondContact NH1-OD1 2.94Å; R317-D816 IonicContact NH1-OD2 2.84Å; R317-D816 PolarHBondContact NH1-OD2 3.46Å; R317-D816 IonicContact NH2-OD2 2.82Å
817	Y	30.2	Very low	30.1	Very low	168 Å²	168	119.4 Å²	119.4	66%	0.659	63%	0.627	S	S	*	*			cis	-149.4	122.8	21.4	-68.4	-98.9	0	0	0	116.1	Q318 G319	Q318-Y817 CarbonylContact O-C 3.54Å; G319-Y817 VanDerWaalsContact CA-O 3.27Å; G319-Y817 WeakPolarHBondContact CA-O 3.45Å
818	D	28.1	Very low	29.3	Very low	60 Å²	60	118 Å²	118	32%	0.321	62%	0.62	S	S	.	*			trans	51.3	109	140.9	-69.3	-40	0	0	0	122	R317 Q318 G319 S320	R317-D818 IonicContact CZ-OD1 3.84Å; R317-D818 IonicContact CZ-OD2 3.26Å; R317-D818 IonicContact NE-OD1 3.45Å; R317-D818 PolarHBondContact NE-OD1 3.25Å; R317-D818 IonicContact NE-OD2 2.76Å; R317-D818 IonicContact NH2-OD1 2.94Å; R317-D818 PolarHBondContact NH2-OD1 3.31Å; R317-D818 VanDerWaalsContact NH2-OD1 3.17Å; R317-D818 IonicContact NH2-OD2 3.4Å; R317-D818 PolarHBondContact NH2-OD2 3.48Å; Q318-D818 PolarHBondContact O-N 3.09Å; Q318-D818 VanDerWaalsContact O-N 3.13Å; G319-D818 WeakPolarHBondContact CA-O 3.46Å; S320-D818 WeakPolarHBondContact CA-O 3.25Å; S320-D818 WeakPolarHBondContact CB-O 3.43Å
819	V	27.3	Very low	29.3	Very low	50 Å²	50	120.3 Å²	120.3	30%	0.303	62%	0.616	S	S	.	*				94.9	135.9	80.8	159	0	0	0	0	111	S320 T321	S320-V819 CarbonylContact C-O 3.41Å; S320-V819 VanDerWaalsContact CA-O 3.27Å; S320-V819 WeakPolarHBondContact CA-O 3.23Å; T321-V819 PolarHBondContact N-O 2.94Å
820	D	27.5	Very low	29.4	Very low	103 Å²	103	121.1 Å²	121.1	55%	0.551	62%	0.615	S	S	*	*			trans	77.5	167.8	175.4	-89.2	24.1	0	0	0	119.1	S320 T321 M322	S320-D820 CarbonylContact C-O 3.55Å; T321-D820 VanDerWaalsContact C-C 3.48Å; T321-D820 PolarHBondContact N-O 3.26Å; T321-D820 VanDerWaalsContact N-O 3.14Å; M322-D820 WeakPolarHBondContact O-CB 3.49Å; M322-D820 VanDerWaalsContact O-CG 3.25Å
821	D	28.9	Very low	29.4	Very low	115 Å²	115	120 Å²	120	62%	0.615	61%	0.607	S	S	*	*	B	Isolated β-bridge	trans	-155.7	127.4	-172.4	166.4	90.4	0	0	0	113.3	T321 M322	T321-D821 VanDerWaalsContact C-N 3.25Å; T321-D821 CarbonylContact O-C 3.46Å; T321-D821 WeakPolarHBondContact O-CA 3.29Å; T321-D821 PolarHBondContact O-N 3.03Å; M322-D821 CarbonylContact C-O 3.54Å; M322-D821 VanDerWaalsContact N-C 3.28Å; M322-D821 CarbonylContact O-C 3.57Å; M322-D821 VanDerWaalsContact O-C 3.29Å; M322-D821 PolarHBondContact O-N 2.92Å
822	R	30.3	Very low	29.3	Very low	102 Å²	102	124.8 Å²	124.8	39%	0.385	62%	0.618	S	S	.	*			trans	-160.7	170.5	174.7	-141.4	59.1	-92.2	111.7	3.8	119.6	T321 M322 D824	T321-R822 PolarHBondContact O-N 3.01Å; T321-R822 VanDerWaalsContact O-N 3.17Å; M322-R822 HydrophobicContact CB-CB 3.81Å; M322-R822 HydrophobicContact CB-CG 4.3Å; M322-R822 HydrophobicContact CE-CB 4.44Å; R822-D824 WeakPolarHBondContact CD-OD2 3.12Å; R822-D824 IonicContact CZ-OD1 2.91Å; R822-D824 IonicContact CZ-OD2 3.38Å; R822-D824 IonicContact NE-OD1 3.13Å; R822-D824 IonicContact NE-OD2 2.73Å; R822-D824 PolarHBondContact NE-OD2 2.88Å; R822-D824 IonicContact NH2-OD1 2.75Å; R822-D824 PolarHBondContact NH2-OD1 3.32Å; R822-D824 IonicContact NH2-OD2 3.57Å
823	E	28.2	Very low	29.3	Very low	151 Å²	151	121.5 Å²	121.5	71%	0.706	62%	0.615	S	S	*	*			trans	90	87.2	165.5	-58.7	-169	179.2	0	0	116.8	M322	M322-E823 HydrophobicContact CE-CG 4.19Å; M322-E823 WeakPolarHBondContact CE-OE1 3.3Å
824	D	28.4	Very low	29.1	Very low	109 Å²	109	120.9 Å²	120.9	58%	0.583	62%	0.621	S	S	*	*				71.9	149.4	51.8	-58.3	-29.5	0	0	0	115.7	R822	R822-D824 WeakPolarHBondContact CD-OD2 3.12Å; R822-D824 IonicContact CZ-OD1 2.91Å; R822-D824 IonicContact CZ-OD2 3.38Å; R822-D824 IonicContact NE-OD1 3.13Å; R822-D824 IonicContact NE-OD2 2.73Å; R822-D824 PolarHBondContact NE-OD2 2.88Å; R822-D824 IonicContact NH2-OD1 2.75Å; R822-D824 PolarHBondContact NH2-OD1 3.32Å; R822-D824 IonicContact NH2-OD2 3.57Å
825	H	30.9	Very low	28.9	Very low	157 Å²	157	121.6 Å²	121.6	73%	0.727	63%	0.625	S	S	*	*			trans	69.3	144.7	-170.5	-86.6	-85.8	0	0	0	116.6
826	D	29.9	Very low	28.8	Very low	140 Å²	140	123 Å²	123	75%	0.749	63%	0.629	S	S	*	*			cis	-106.3	159	-14.5	-61.9	-60.2	0	0	0	108.9
827	D	30.2	Very low	28.6	Very low	118 Å²	118	125.7 Å²	125.7	63%	0.631	64%	0.643	S	S	*	*			cis	73.5	122.5	37.1	-82	-15.4	0	0	0	116.8
828	D	30.3	Very low	28.6	Very low	129 Å²	129	120.8 Å²	120.8	69%	0.69	64%	0.644	S	S	*	*			trans	75.4	139.3	142.2	-62.6	-14.7	0	0	0	118.8
829	N	28.9	Very low	28.5	Very low	118 Å²	118	126.7 Å²	126.7	63%	0.631	67%	0.668	S	S	*	*			cis	179.5	161.6	-7.4	-116.5	-35.9	0	0	0	105.2
830	E	26.6	Very low	28.4	Very low	164 Å²	164	129.5 Å²	129.5	77%	0.766	69%	0.685	S	S	*	*			trans	76.1	145.1	142.8	-75.3	175.9	178.3	0	0	121.6
831	I	28.4	Very low	28.4	Very low	117 Å²	117	132.2 Å²	132.2	60%	0.6	70%	0.696	S	S	*	*			cis	-157.8	133.2	-9.5	-179.6	163.7	0	0	0	111.7
832	Y	27.2	Very low	28.5	Very low	227 Å²	227	132.8 Å²	132.8	89%	0.89	70%	0.699	S	S	*	*			trans	45.2	-137	172.2	-49.6	151.4	0	0	0	113.3
833	G	28.9	Very low	28.5	Very low	65 Å²	65	133 Å²	133	67%	0.67	72%	0.717	S	S	*	*			cis	-172.2	127.2	-22.2	0	0	0	0	0	109.1
834	S	27.8	Very low	28.4	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	72%	0.724	S	S	*	*			cis	-173.7	139.7	26.1	48	0	0	0	0	111.4
835	N	27.7	Very low	28.6	Very low	137 Å²	137	138.4 Å²	138.4	73%	0.733	73%	0.732	S	S	*	*			trans	45.2	127.9	132.6	-66.6	-17.8	0	0	0	123.3
836	M	28.1	Very low	28.3	Very low	162 Å²	162	133.4 Å²	133.4	80%	0.798	71%	0.714	S	S	*	*				168	108.2	111.3	-85.7	-76.4	-179.6	0	0	108
837	N	27.8	Very low	27.9	Very low	136 Å²	136	133 Å²	133	73%	0.727	70%	0.702	S	S	*	*				79.4	127.6	76.8	-76	-12.8	0	0	0	115.4
838	G	29.1	Very low	27.8	Very low	66 Å²	66	130.3 Å²	130.3	68%	0.68	69%	0.692	S	S	*	*			trans	142.4	77.2	162.4	0	0	0	0	0	113.6
839	F	25.7	Very low	27.6	Very low	184 Å²	184	126.5 Å²	126.5	81%	0.807	68%	0.676	S	S	*	*				59.7	97.9	99.8	-84.1	-94.4	0	0	0	113.9
840	T	26.5	Very low	27.3	Very low	109 Å²	109	127.6 Å²	127.6	67%	0.669	69%	0.687	S	S	*	*				75.3	150	89.4	61.9	0	0	0	0	115.9
841	M	26.9	Very low	27.1	Very low	160 Å²	160	123.9 Å²	123.9	79%	0.788	68%	0.676	S	S	*	*			trans	98.1	99.9	166.5	-64.7	-90.8	171.2	0	0	113.6
842	N	30.5	Very low	26.8	Very low	126 Å²	126	125.8 Å²	125.8	67%	0.674	68%	0.684	S	S	*	*				57.8	99.9	82.5	-78.1	-18.1	0	0	0	113.7
843	S	30.8	Very low	26.7	Very low	108 Å²	108	119.7 Å²	119.7	76%	0.755	67%	0.671	S	S	*	*			trans	177.9	115.6	142.9	39	0	0	0	0	106.8
844	R	25	Very low	26.7	Very low	227 Å²	227	122 Å²	122	86%	0.857	67%	0.671	S	S	*	*				76	91.2	58	-64.9	175.6	-178.9	-178.5	-0.1	111.9
845	L	33	Very low	26.7	Very low	145 Å²	145	122.7 Å²	122.7	76%	0.759	67%	0.671	S	S	*	*			trans	-68.1	171.1	167.7	-56.8	-179.4	0	0	0	110.6
846	P	24.3	Very low	26.8	Very low	53 Å²	53	122 Å²	122	34%	0.344	68%	0.677	S	S	.	*			cis	-75.9	-171.8	32.3	29.8	-38.6	0	0	0	116	V733	V733-P846 HydrophobicContact CG1-CG 3.85Å
847	R	22	Very low	27	Very low	130 Å²	130	117.5 Å²	117.5	49%	0.491	67%	0.672	S	S	.	*			trans	95.7	146.7	-171	-142.5	51.6	28.9	66.7	8.2	115.9	F735 I736	F735-R847 PolarHBondContact O-NH2 3.48Å; I736-R847 VanDerWaalsContact O-CA 3.24Å; I736-R847 WeakPolarHBondContact O-CA 3.23Å; I736-R847 PolarHBondContact O-N 3.03Å; I736-R847 PolarHBondContact O-NE 3.41Å
848	S	27.7	Very low	27.1	Very low	62 Å²	62	120.1 Å²	120.1	43%	0.434	68%	0.68	S	S	.	*			trans	-174.5	-173.8	-159	46.5	0	0	0	0	107.7	D737	D737-S848 WeakPolarHBondContact CA-OG 3.47Å; D737-S848 PolarHBondContact N-OG 2.9Å; D737-S848 PolarHBondContact O-OG 3.38Å
849	S	27	Very low	26.8	Very low	50 Å²	50	122.3 Å²	122.3	35%	0.35	68%	0.682	S	S	.	*			trans	68.3	103.8	161.9	-57.5	0	0	0	0	116.1	D737 Y738	D737-S849 PolarHBondContact O-OG 3.39Å; D737-S849 VanDerWaalsContact O-OG 3.13Å; Y738-S849 PolarHBondContact O-OG 3.06Å
850	T	21.6	Very low	26.7	Very low	140 Å²	140	120.4 Å²	120.4	86%	0.859	68%	0.68	S	S	*	*			trans	-168.8	93.8	165.1	-69.1	0	0	0	0	104.6
851	T	23.4	Very low	26.5	Very low	86 Å²	86	123.6 Å²	123.6	53%	0.528	69%	0.691	S	S	.	*			cis	81.5	140	19.9	-43.1	0	0	0	0	113.9
852	M	22	Very low	26.1	Very low	158 Å²	158	120.6 Å²	120.6	78%	0.778	69%	0.685	S	S	*	*			trans	77.3	124.2	-178	-74.8	-152.8	131.8	0	0	115.3
853	T	25.4	Very low	25.7	Very low	99 Å²	99	118.9 Å²	118.9	61%	0.607	68%	0.684	S	S	*	*			cis	-164.3	116.2	27.8	11.1	0	0	0	0	110.1
854	T	27.8	Very low	25.2	Very low	112 Å²	112	119.2 Å²	119.2	69%	0.687	68%	0.677	S	S	*	*				70.4	125	106.9	63.6	0	0	0	0	112.2
855	V	27.3	Very low	25.1	Very low	127 Å²	127	113.4 Å²	113.4	77%	0.77	67%	0.666	S	S	*	*				-162.1	137.1	74.6	171.9	0	0	0	0	108.9
856	S	31	Very low	24.6	Very low	123 Å²	123	113.7 Å²	113.7	86%	0.86	67%	0.668	S	S	*	*			trans	64.9	165.6	-170.4	81.3	0	0	0	0	114.2
857	G	31.8	Very low	24.4	Very low	67 Å²	67	118.4 Å²	118.4	69%	0.691	68%	0.679	S	S	*	*			cis	-176.2	161.9	-3.7	0	0	0	0	0	110.5
858	E	29.3	Very low	24.5	Very low	190 Å²	190	123.4 Å²	123.4	89%	0.888	70%	0.699	S	S	*	*			cis	-136.1	152.3	-2.1	-68.5	-167.3	91.4	0	0	111.1
859	P	23.8	Very low	24.3	Very low	112 Å²	112	124.4 Å²	124.4	73%	0.727	70%	0.7	S	S	*	*			trans	-99.2	-163.6	-171.9	40.4	-37.9	0	0	0	113.9
860	L	22.8	Very low	24.2	Very low	145 Å²	145	126.9 Å²	126.9	76%	0.759	71%	0.709	S	S	*	*			trans	69.2	51.5	160.6	-60.5	165.3	0	0	0	115.2	S862	L860-S862 PolarHBondContact O-N 3.22Å; L860-S862 PolarHBondContact O-OG 3.31Å
861	I	22.8	Very low	24.5	Very low	175 Å²	175	126.4 Å²	126.4	90%	0.897	70%	0.695	S	S	*	*				23.4	89	126.3	-46.9	172.9	0	0	0	113.9
862	S	18.7	Very low	24.7	Very low	97 Å²	97	125.6 Å²	125.6	68%	0.678	70%	0.704	S	S	*	*			trans	-118.3	147.4	-179.6	-84.5	0	0	0	0	112.8	L860	L860-S862 PolarHBondContact O-N 3.22Å; L860-S862 PolarHBondContact O-OG 3.31Å
863	S	22	Very low	25	Very low	91 Å²	91	121.1 Å²	121.1	64%	0.636	68%	0.683	S	S	*	*			cis	76.9	156	33.2	106.1	0	0	0	0	113.3
864	N	21	Very low	25.4	Very low	115 Å²	115	120.3 Å²	120.3	62%	0.615	68%	0.678	S	S	*	*			cis	-144.4	122.6	16.5	-151.9	-77.4	0	0	0	113.4	L866	N864-L866 PolarHBondContact O-N 2.93Å
865	V	21.5	Very low	25.9	Very low	104 Å²	104	122.9 Å²	122.9	63%	0.63	68%	0.684	S	S	*	*			trans	55.6	-15.2	158.5	175.3	0	0	0	0	120.1	R867	V865-R867 WeakPolarHBondContact O-CG 3.02Å; V865-R867 PolarHBondContact O-NE 2.9Å
866	L	22.6	Very low	26.5	Very low	151 Å²	151	120.3 Å²	120.3	79%	0.791	68%	0.684	S	S	*	*			trans	-105	171.4	-169.2	-90.4	58.2	0	0	0	113.9	N864	N864-L866 PolarHBondContact O-N 2.93Å
867	R	21.3	Very low	26.7	Very low	153 Å²	153	119.2 Å²	119.2	58%	0.577	67%	0.672	S	S	*	*				-179.8	128.2	-80.9	-93.1	172.9	-163.5	-165.9	2.8	110.8	V865	V865-R867 WeakPolarHBondContact O-CG 3.02Å; V865-R867 PolarHBondContact O-NE 2.9Å
868	Y	24	Very low	26.8	Very low	234 Å²	234	119.4 Å²	119.4	92%	0.918	66%	0.662	S	S	*	*				-152.3	83.7	117.6	-120	-84.7	0	0	0	107
869	N	22.6	Very low	26.8	Very low	83 Å²	83	117 Å²	117	44%	0.444	66%	0.661	S	S	.	*				57.9	140.5	86.9	-90.8	10.3	0	0	0	114.3
870	D	26.5	Very low	27.5	Very low	102 Å²	102	117.8 Å²	117.8	55%	0.545	66%	0.663	S	S	.	*			cis	-159.9	164.5	6.5	-128.9	-14.2	0	0	0	109.6
871	K	27.6	Very low	28.6	Very low	130 Å²	130	115 Å²	115	57%	0.565	66%	0.656	S	S	*	*			cis	-155.2	137.7	1.8	-168.2	157.6	-141	69.8	0	113.2	N873	K871-N873 PolarHBondContact O-ND2 3.09Å
872	G	27.5	Very low	29	Very low	69 Å²	69	114.4 Å²	114.4	71%	0.711	65%	0.649	S	S	*	*			trans	80.9	-147.3	152.5	0	0	0	0	0	116.7
873	N	28.7	Very low	29.3	Very low	64 Å²	64	115.2 Å²	115.2	34%	0.342	65%	0.645	S	S	.	*			cis	-155.5	-168.3	14.6	-135.8	-64.9	0	0	0	114.8	L689 N692 K871	L689-N873 PolarHBondContact O-N 3.37Å; N692-N873 HydrophobicContact CB-CB 3.79Å; N692-N873 VanDerWaalsContact CB-CG 3.49Å; N692-N873 WeakPolarHBondContact CB-OD1 3.38Å; N692-N873 PolarHBondContact ND2-OD1 3Å; K871-N873 PolarHBondContact O-ND2 3.09Å
874	T	33	Very low	29.4	Very low	82 Å²	82	113.5 Å²	113.5	50%	0.503	64%	0.642	S	S	.	*			trans	74.3	157.5	-175.9	75.5	0	0	0	0	114.6	S691 N692	S691-T874 WeakPolarHBondContact O-CG2 3.18Å; N692-T874 HydrophobicContact CB-CG2 3.99Å
875	M	37.3	Very low	29.7	Very low	167 Å²	167	112.4 Å²	112.4	82%	0.823	64%	0.643	S	S	*	*			cis	-161.5	168.4	-30.6	174.1	159.6	168.3	0	0	108.9
876	G	39.8	Very low	30	Very low	73 Å²	73	112.1 Å²	112.1	75%	0.753	65%	0.646	S	S	*	*			trans	93.5	84	-169.6	0	0	0	0	0	109.9
877	T	36.1	Very low	30.1	Very low	100 Å²	100	114.7 Å²	114.7	61%	0.613	65%	0.645	S	S	*	*			trans	-142.8	140.6	-163	58.1	0	0	0	0	112.9	T879	T877-T879 PolarHBondContact O-OG1 3.01Å
878	S	34.5	Very low	30.4	Very low	70 Å²	70	114.6 Å²	114.6	49%	0.49	65%	0.654	S	S	.	*			trans	-53.7	147.6	176.1	52.9	0	0	0	0	113.5	S881	S878-S881 WeakPolarHBondContact CB-O 3.28Å; S878-S881 PolarHBondContact OG-O 2.88Å
879	T	29.7	Very low	30.5	Very low	140 Å²	140	111.9 Å²	111.9	86%	0.859	64%	0.643	S	S	*	*	S	Bend	cis	47.3	67	-4.6	65.3	0	0	0	0	116.9	T877	T877-T879 PolarHBondContact O-OG1 3.01Å
880	V	36.9	Very low	30.7	Very low	129 Å²	129	112.1 Å²	112.1	78%	0.782	64%	0.644	S	S	*	*	S	Bend	cis	-142.9	139.8	-8.4	63.2	0	0	0	0	109.3
881	S	47.4	Very low	30.7	Very low	85 Å²	85	108.9 Å²	108.9	59%	0.594	63%	0.634	S	S	*	*			trans	62	-137.4	-177.4	-51.2	0	0	0	0	112.6	S878	S878-S881 WeakPolarHBondContact CB-O 3.28Å; S878-S881 PolarHBondContact OG-O 2.88Å
882	H	30.4	Very low	30.6	Very low	164 Å²	164	108.5 Å²	108.5	76%	0.759	64%	0.643	S	S	*	*			cis	-153.6	135.5	0.8	177.1	-89.9	0	0	0	110.5
883	L	24	Very low	30.5	Very low	113 Å²	113	112.1 Å²	112.1	59%	0.592	65%	0.645	S	S	*	*			cis	-112.5	-31.6	-10.3	-172.4	53.9	0	0	0	115.1
884	G	24	Very low	30.4	Very low	56 Å²	56	116 Å²	116	58%	0.577	66%	0.661	S	S	*	*			cis	-67.2	-66.9	1	0	0	0	0	0	114.4	S886	G884-S886 PolarHBondContact O-N 3Å
885	S	29.3	Very low	30.2	Very low	92 Å²	92	116.8 Å²	116.8	64%	0.643	66%	0.659	S	S	*	*			trans	53.9	32.7	-178	-55.3	0	0	0	0	115.1
886	S	26.3	Very low	29.6	Very low	98 Å²	98	115 Å²	115	69%	0.685	65%	0.649	S	S	*	*			trans	-59.5	136.1	175.1	-59.5	0	0	0	0	112.1	G884	G884-S886 PolarHBondContact O-N 3Å
887	R	24.6	Very low	28.8	Very low	205 Å²	205	117.1 Å²	117.1	77%	0.774	64%	0.635	S	S	*	*			cis	56.1	95.6	4.6	-69.4	-177.2	168.5	-82.1	2.5	115.5
888	I	29.3	Very low	28.5	Very low	150 Å²	150	118.9 Å²	118.9	77%	0.769	64%	0.636	S	S	*	*			cis	67.2	131.2	10	-46.8	174.9	0	0	0	113.3
889	R	25.8	Very low	28.1	Very low	178 Å²	178	120.1 Å²	120.1	67%	0.672	64%	0.636	S	S	*	*			trans	60.4	133.5	-141.3	-73.3	-157.4	158	-103.2	-4.1	111.9
890	D	25.5	Very low	28	Very low	87 Å²	87	118.9 Å²	118.9	47%	0.465	62%	0.624	S	S	.	*			cis	-142.3	160.6	1.3	-100.8	-30.4	0	0	0	111.6
891	G	28.2	Very low	27.5	Very low	34 Å²	34	118.6 Å²	118.6	35%	0.351	62%	0.618	S	S	.	*			cis	85.2	26.7	8.1	0	0	0	0	0	114	I893	G891-I893 VanDerWaalsContact C-N 3.32Å; G891-I893 PolarHBondContact O-N 2.72Å
892	T	24.7	Very low	26.6	Very low	122 Å²	122	123.3 Å²	123.3	75%	0.748	63%	0.631	S	S	*	*	S	Bend	trans	-75.3	68.7	-154.4	-41.2	0	0	0	0	114.8
893	I	25	Very low	26.5	Very low	146 Å²	146	118.1 Å²	118.1	75%	0.749	62%	0.622	S	S	*	*	S	Bend	trans	62	84.6	169.2	-49.5	178.5	0	0	0	112.3	G891	G891-I893 VanDerWaalsContact C-N 3.32Å; G891-I893 PolarHBondContact O-N 2.72Å
894	Q	25.8	Very low	26.8	Very low	144 Å²	144	119.8 Å²	119.8	67%	0.673	63%	0.632	S	S	*	*			cis	-153	179.1	6.6	-46.3	177.2	22.2	0	0	110.6
895	Q	29.6	Very low	26.8	Very low	100 Å²	100	120.9 Å²	120.9	47%	0.467	63%	0.631	S	S	.	*			trans	66	174.5	156	-68.6	168.4	46.7	0	0	114.6
896	Q	25.4	Very low	26.6	Very low	130 Å²	130	121.2 Å²	121.2	61%	0.607	63%	0.633	S	S	*	*			cis	-106.5	-7.8	-14.8	-156.6	65	-90.9	0	0	113.1
897	Y	22.5	Very low	26.6	Very low	116 Å²	116	119.8 Å²	119.8	46%	0.455	61%	0.612	S	S	.	*	S	Bend	trans	68.2	151.8	-171	-49.5	-67.4	0	0	0	113.3	N1045	Y897-N1045 VanDerWaalsContact C-OD1 3.25Å; Y897-N1045 PolarHBondContact O-ND2 3.31Å; Y897-N1045 PolarHBondContact O-OD1 2.73Å
898	H	29.5	Very low	27.4	Very low	138 Å²	138	112.6 Å²	112.6	64%	0.639	59%	0.593	S	S	*	*	S	Bend	cis	-78.2	-18.8	0.6	-158	-61.7	0	0	0	114.5	N1045	H898-N1045 PolarHBondContact N-OD1 2.53Å
899	L	27	Very low	27.4	Very low	96 Å²	96	110.5 Å²	110.5	50%	0.503	58%	0.579	S	S	.	*			trans	66.3	138.6	-174.9	-85.5	64.5	0	0	0	115.8
900	N	27.6	Very low	27.8	Very low	113 Å²	113	107.7 Å²	107.7	60%	0.604	58%	0.578	S	S	*	*			cis	-166	149.2	-23	-127.7	49.4	0	0	0	109.6
901	D	26	Very low	28.1	Very low	123 Å²	123	108.9 Å²	108.9	66%	0.658	59%	0.588	S	S	*	*			trans	56.9	161.3	158.3	-32.6	-44.2	0	0	0	118.3
902	E	27.8	Very low	28.2	Very low	184 Å²	184	113.8 Å²	113.8	86%	0.86	61%	0.606	S	S	*	*			cis	73.7	155.4	9.1	-53.8	-167.1	149	0	0	115.4
903	G	28.7	Very low	28.5	Very low	56 Å²	56	114.5 Å²	114.5	58%	0.577	61%	0.606	S	S	*	*			cis	-155.4	154.8	5.5	0	0	0	0	0	108.1
904	N	29.5	Very low	28.6	Very low	148 Å²	148	114.7 Å²	114.7	79%	0.791	61%	0.605	S	S	*	*				63.1	128.3	94.1	-73.9	-12.8	0	0	0	112.5
905	S	25.3	Very low	28.7	Very low	79 Å²	79	112 Å²	112	55%	0.552	60%	0.602	S	S	*	*			cis	-160.3	143	42.5	50.6	0	0	0	0	111.6
906	S	25.3	Very low	28.6	Very low	99 Å²	99	112.2 Å²	112.2	69%	0.692	61%	0.614	S	S	*	*			trans	-170.6	166.3	176.8	-70.8	0	0	0	0	108.9	Y742	Y742-S906 PolarHBondContact N-O 3.38Å; Y742-S906 CarbonylContact O-C 3.6Å; Y742-S906 WeakPolarHBondContact O-CA 3.21Å
907	R	25.2	Very low	28.8	Very low	67 Å²	67	112.8 Å²	112.8	25%	0.253	62%	0.617	S	S	.	*			trans	-102.7	147.1	-174.1	-170.1	179.3	-71.3	111.6	-9.2	114.2	Y738 D741 Y742 D743	Y738-R907 WeakPolarHBondContact OH-CD 3.4Å; Y738-R907 VanDerWaalsContact OH-CZ 3.3Å; Y738-R907 PolarHBondContact OH-NE 3.04Å; Y738-R907 PolarHBondContact OH-NH1 2.88Å; D741-R907 VanDerWaalsContact CG-NH2 3.29Å; D741-R907 IonicContact OD1-CZ 3.93Å; D741-R907 IonicContact OD1-NE 3.82Å; D741-R907 PolarHBondContact OD1-NE 3.07Å; D741-R907 IonicContact OD1-NH2 2.82Å; D741-R907 PolarHBondContact OD1-NH2 3.19Å; D741-R907 IonicContact OD2-CZ 2.7Å; D741-R907 IonicContact OD2-NH2 2.77Å; D741-R907 PolarHBondContact OD2-NH2 3.33Å; D741-R907 VanDerWaalsContact OD2-NH2 3.09Å; Y742-R907 WeakPolarHBondContact O-CB 3.33Å; Y742-R907 PolarHBondContact O-N 2.84Å; D743-R907 IonicContact OD2-CZ 2.87Å; D743-R907 IonicContact OD2-NH1 2.71Å; D743-R907 PolarHBondContact OD2-NH1 2.87Å; D743-R907 IonicContact OD2-NH2 2.61Å; D743-R907 PolarHBondContact OD2-NH2 2.96Å
908	P	41.7	Very low	29.2	Very low	55 Å²	55	112.4 Å²	112.4	36%	0.357	62%	0.622	S	S	.	*			trans	-69.2	-150.1	158.5	-17.7	32.6	0	0	0	112.5	D741 N910	D741-P908 WeakPolarHBondContact O-CD 3.09Å; P908-N910 HydrophobicContact CB-CB 4.27Å
909	H	28.6	Very low	29.3	Very low	106 Å²	106	113.7 Å²	113.7	49%	0.491	63%	0.626	S	S	.	*			cis	-134.1	116.8	4.2	-111.2	-72.4	0	0	0	105.8	N739 E740	N739-H909 PolarHBondContact O-CD2 2.77Å; N739-H909 PolarHBondContact O-CE1 3.38Å; N739-H909 PolarHBondContact O-NE2 2.82Å; E740-H909 PolarHBondContact N-CD2 2.82Å; E740-H909 PolarHBondContact N-NE2 3.34Å
910	N	35.7	Very low	29.5	Very low	119 Å²	119	115.7 Å²	115.7	64%	0.636	63%	0.631	S	S	*	*			cis	65.8	137.1	23.6	-48.6	-27	0	0	0	113.6	P908	P908-N910 HydrophobicContact CB-CB 4.27Å
911	T	31.6	Very low	29.7	Very low	112 Å²	112	114.5 Å²	114.5	69%	0.687	63%	0.631	S	S	*	*			cis	-120.7	-176	12.1	47.6	0	0	0	0	113.6
912	D	29.4	Very low	30	Very low	136 Å²	136	115.9 Å²	115.9	73%	0.727	63%	0.631	S	S	*	*			trans	70.3	114.6	154.9	-55.2	-45.7	0	0	0	118.2
913	D	30.3	Very low	30.1	Very low	138 Å²	138	115 Å²	115	74%	0.738	62%	0.622	S	S	*	*			cis	63	141.4	9.3	-96.4	-11.5	0	0	0	112.7
914	M	28.8	Very low	30.2	Very low	150 Å²	150	118.2 Å²	118.2	74%	0.739	63%	0.625	S	S	*	*			cis	170	-172.1	41.5	-124.6	-95.9	166.3	0	0	111.3
915	S	26.6	Very low	30.1	Very low	86 Å²	86	113.7 Å²	113.7	60%	0.601	60%	0.604	S	S	*	*			trans	-26.6	151.3	167.5	-74.9	0	0	0	0	117.9
916	S	27.8	Very low	30.4	Very low	105 Å²	105	113.1 Å²	113.1	73%	0.734	61%	0.605	S	S	*	*			cis	-153.3	119	47.2	168.3	0	0	0	0	117
917	Q	30.9	Very low	31.1	Very low	143 Å²	143	111.5 Å²	111.5	67%	0.668	59%	0.591	S	S	*	*				31.8	146.4	115.3	-50.9	-167.8	-12.3	0	0	122.3
918	L	29.4	Very low	31.7	Very low	107 Å²	107	116.1 Å²	116.1	56%	0.56	61%	0.608	S	S	*	*				99.7	167.5	123.3	-125.1	82	0	0	0	122.3	K667	K667-L918 PolarHBondContact NZ-O 3.3Å
919	K	32.3	Very low	31.7	Very low	165 Å²	165	115.5 Å²	115.5	72%	0.717	60%	0.602	S	S	*	*			trans	76	128.9	174.3	-67.2	141.6	-178.3	168.8	0	114.1	K667	K667-K919 WeakPolarHBondContact CD-O 3.05Å; K667-K919 WeakPolarHBondContact CE-O 3.32Å; K667-K919 PolarHBondContact NZ-O 3.29Å
920	K	32	Very low	32.3	Very low	138 Å²	138	114.4 Å²	114.4	60%	0.6	60%	0.6	S	S	*	*			trans	-128.4	166.2	-162.3	174.8	-175.7	173.9	-172.9	0	109.2	A671	A671-K920 HydrophobicContact CB-CD 4.12Å; A671-K920 VanDerWaalsContact CB-CE 3.41Å
921	S	31.4	Very low	32.6	Very low	88 Å²	88	114.3 Å²	114.3	62%	0.615	60%	0.599	S	S	*	*			trans	84.2	157.8	163.8	93.2	0	0	0	0	114.6
922	K	31.9	Very low	32.7	Very low	152 Å²	152	115.6 Å²	115.6	66%	0.661	60%	0.602	S	S	*	*			cis	-165.9	142	14.7	-136	151.2	-176.6	-177.7	0	104.7
923	Y	29.7	Very low	33.5	Very low	167 Å²	167	112.2 Å²	112.2	66%	0.655	60%	0.599	S	S	*	*			trans	40.1	145.7	130	-54	-129	0	0	0	118.5
924	L	31	Very low	34.3	Very low	123 Å²	123	111.7 Å²	111.7	64%	0.644	60%	0.596	S	S	*	*			cis	177.5	137.5	49.5	-139.2	128.5	0	0	0	103.4
925	S	27.4	Very low	34.9	Very low	52 Å²	52	114.4 Å²	114.4	36%	0.364	60%	0.598	S	S	.	*			trans	-9.5	141.3	133.2	46.8	0	0	0	0	115.8	T1724	S925-T1724 WeakPolarHBondContact CA-O 3.32Å; S925-T1724 VanDerWaalsContact CB-O 3.27Å; S925-T1724 WeakPolarHBondContact CB-O 3.39Å
926	A	31.8	Very low	35.4	Very low	68 Å²	68	115.4 Å²	115.4	56%	0.562	60%	0.597	S	S	*	*				-173.7	124	93.2	0	0	0	0	0	108.8
927	T	40	Very low	35.3	Very low	65 Å²	65	114 Å²	114	40%	0.399	60%	0.6	S	S	.	*				74.2	86.6	65.2	66	0	0	0	0	116.2	T1724 D1725	T927-T1724 WeakPolarHBondContact CG2-O 3.37Å; T927-T1724 PolarHBondContact N-OG1 2.91Å; T927-D1725 HydrophobicContact CG2-CB 3.77Å
928	R	37.7	Very low	35.5	Very low	163 Å²	163	117.8 Å²	117.8	62%	0.615	61%	0.609	S	S	*	*			trans	-150	158	139.2	-103.5	-158	77.4	140	2.1	109.5	N930	R928-N930 HydrophobicContact CG-CB 3.93Å; R928-N930 PolarHBondContact NH1-ND2 2.88Å; R928-N930 VanDerWaalsContact NH1-ND2 3.2Å
929	N	41.4	Very low	36.2	Very low	42 Å²	42	117.8 Å²	117.8	23%	0.225	62%	0.618	C	S	.	*			cis	-60.5	146.3	-11.7	-115.7	38.2	0	0	0	110.4	D931 T1323	N929-D931 PolarHBondContact ND2-OD2 3.39Å; N929-T1323 HydrophobicContact CB-CG2 4.13Å; N929-T1323 VanDerWaalsContact CG-CG2 3.49Å
930	N	40.6	Very low	36.9	Very low	83 Å²	83	113.3 Å²	113.3	44%	0.444	61%	0.608	S	S	.	*			cis	53.9	103.7	42.9	-93.2	23.4	0	0	0	113.3	R928	R928-N930 HydrophobicContact CG-CB 3.93Å; R928-N930 PolarHBondContact NH1-ND2 2.88Å; R928-N930 VanDerWaalsContact NH1-ND2 3.2Å
931	D	42.5	Very low	37.5	Very low	118 Å²	118	114.1 Å²	114.1	63%	0.631	61%	0.607	S	S	*	*				-175.2	112.8	110	-77.2	-28.4	0	0	0	104.5	N929 G933	N929-D931 PolarHBondContact ND2-OD2 3.39Å; D931-G933 PolarHBondContact O-N 3.42Å
932	N	33.9	Very low	38	Very low	139 Å²	139	116.9 Å²	116.9	74%	0.743	62%	0.615	S	S	*	*				40	35.2	90.5	-76.2	-3	0	0	0	114.5	N934	N932-N934 WeakPolarHBondContact O-CB 3.42Å; N932-N934 PolarHBondContact O-ND2 3.48Å
933	G	46.8	Very low	38.4	Very low	65 Å²	65	118 Å²	118	67%	0.67	62%	0.62	S	S	*	*			trans	-66.1	128.6	131.2	0	0	0	0	0	108.4	D931	D931-G933 PolarHBondContact O-N 3.42Å
934	N	45.8	Very low	39.1	Very low	126 Å²	126	116.7 Å²	116.7	67%	0.674	62%	0.619	S	S	*	*			cis	61.2	150.2	8.6	-66.8	-64.5	0	0	0	116.1	N932	N932-N934 WeakPolarHBondContact O-CB 3.42Å; N932-N934 PolarHBondContact O-ND2 3.48Å
935	R	41.7	Very low	39.6	Very low	207 Å²	207	112.8 Å²	112.8	78%	0.781	61%	0.609	S	S	*	*			cis	-87.7	-126.9	-3.9	-157.8	-137.3	140.1	99.3	13.1	112
936	N	37.5	Very low	40.4	Very low	107 Å²	107	119 Å²	119	57%	0.572	62%	0.624	S	S	*	*			trans	-166.1	146.5	-178.1	30.4	80.8	0	0	0	109.3
937	G	25.3	Very low	40.9	Very low	77 Å²	77	121.2 Å²	121.2	79%	0.794	62%	0.618	S	S	*	*			trans	-175.9	174.7	-175.7	0	0	0	0	0	111.2
938	Y	34.7	Very low	41.5	Very low	222 Å²	222	122.1 Å²	122.1	87%	0.871	63%	0.625	S	S	*	*			trans	-157.4	157.4	-179.8	-171.2	-102.5	0	0	0	110.6
939	S	45.6	Very low	42.2	Very low	107 Å²	107	117.8 Å²	117.8	75%	0.748	62%	0.62	S	S	*	*			trans	-73.1	127	178.6	-174.7	0	0	0	0	111.6
940	S	45.4	Very low	42.8	Very low	71 Å²	71	117.7 Å²	117.7	50%	0.497	62%	0.622	S	S	.	*			trans	-148	114.2	-172.8	-161.3	0	0	0	0	110.5	R946 R947	S940-R946 CarbonylContact C-O 3.18Å; S940-R946 VanDerWaalsContact C-O 3.25Å; S940-R946 WeakPolarHBondContact CB-O 3.48Å; S940-R946 CarbonylContact O-C 3.32Å; S940-R946 PolarHBondContact OG-O 2.97Å; S940-R947 PolarHBondContact O-N 3.21Å
941	R	44.9	Very low	43.1	Very low	154 Å²	154	121.5 Å²	121.5	58%	0.581	64%	0.637	S	S	*	*			cis	-165.1	153.2	4	-164.9	176.8	178.8	-154.5	7.8	109.2	H944 G945 R946	R941-H944 VanDerWaalsContact CD-O 3.24Å; R941-H944 WeakPolarHBondContact CD-O 3.4Å; R941-H944 VanDerWaalsContact CZ-O 3.3Å; R941-H944 PolarHBondContact NE-O 3.05Å; R941-H944 PolarHBondContact NH1-O 2.64Å; R941-G945 PolarHBondContact NH1-O 2.64Å; R941-R946 VanDerWaalsContact CB-O 3.26Å; R941-R946 WeakPolarHBondContact CB-O 3.47Å; R941-R946 PolarHBondContact N-O 3.17Å
942	N	42.4	Very low	42.9	Very low	147 Å²	147	123 Å²	123	79%	0.786	65%	0.651	S	S	*	*	S	Bend	trans	-73.4	-178.7	167.5	-159.3	-14.2	0	0	0	110.7	H944	N942-H944 CarbonylContact O-C 3.5Å; N942-H944 PolarHBondContact O-N 3.48Å; N942-H944 VanDerWaalsContact O-O 3.11Å
943	K	40.9	Very low	43.1	Very low	176 Å²	176	119.6 Å²	119.6	77%	0.765	63%	0.633	S	S	*	*	S	Bend	trans	-54.4	123.1	178.9	-175.8	178.3	178.8	179	0	111.3
944	H	44.4	Very low	42.3	Very low	138 Å²	138	121.3 Å²	121.3	64%	0.639	62%	0.623	S	S	*	*	S	Bend	cis	-93.7	148	-6.1	-57.6	107.5	0	0	0	111.6	R941 N942	R941-H944 VanDerWaalsContact CD-O 3.24Å; R941-H944 WeakPolarHBondContact CD-O 3.4Å; R941-H944 VanDerWaalsContact CZ-O 3.3Å; R941-H944 PolarHBondContact NE-O 3.05Å; R941-H944 PolarHBondContact NH1-O 2.64Å; N942-H944 CarbonylContact O-C 3.5Å; N942-H944 PolarHBondContact O-N 3.48Å; N942-H944 VanDerWaalsContact O-O 3.11Å
945	G	40.7	Very low	41.6	Very low	41 Å²	41	122.7 Å²	122.7	42%	0.423	63%	0.626	S	S	.	*			trans	-64.5	-165.1	-166	0	0	0	0	0	118	R941	R941-G945 PolarHBondContact NH1-O 2.64Å
946	R	45	Very low	40.7	Very low	184 Å²	184	118.9 Å²	118.9	69%	0.694	62%	0.621	S	S	*	*			cis	-101	164.1	3.5	-67.9	-171.3	-179.5	-173	2.3	113.5	S940 R941 P948	S940-R946 CarbonylContact C-O 3.18Å; S940-R946 VanDerWaalsContact C-O 3.25Å; S940-R946 WeakPolarHBondContact CB-O 3.48Å; S940-R946 CarbonylContact O-C 3.32Å; S940-R946 PolarHBondContact OG-O 2.97Å; R941-R946 VanDerWaalsContact CB-O 3.26Å; R941-R946 WeakPolarHBondContact CB-O 3.47Å; R941-R946 PolarHBondContact N-O 3.17Å; R946-P948 WeakPolarHBondContact CB-O 3.27Å
947	R	42.1	Very low	40.3	Very low	114 Å²	114	122 Å²	122	43%	0.43	63%	0.634	S	S	.	*			cis	31.5	100.7	-17	-125.5	175.6	175.5	-78.5	5.1	118.2	S940 S949 N953 E954	S940-R947 PolarHBondContact O-N 3.21Å; R947-S949 WeakPolarHBondContact CG-OG 3.07Å; R947-N953 PolarHBondContact NH2-ND2 3.28Å; R947-E954 IonicContact CZ-OE1 3.76Å; R947-E954 IonicContact CZ-OE2 2.7Å; R947-E954 IonicContact NE-OE1 3.13Å; R947-E954 PolarHBondContact NE-OE1 3.48Å; R947-E954 VanDerWaalsContact NH2-CD 3.28Å; R947-E954 IonicContact NH2-OE1 3.32Å; R947-E954 PolarHBondContact NH2-OE1 3.34Å; R947-E954 IonicContact NH2-OE2 3.94Å; R947-E954 PolarHBondContact NH2-OE2 3.21Å
948	P	51.6	Low	40.3	Very low	84 Å²	84	126.2 Å²	126.2	55%	0.545	64%	0.637	S	S	.	*			cis	-44.1	133.2	0.6	-36.7	40.5	0	0	0	116.9	R946	R946-P948 WeakPolarHBondContact CB-O 3.27Å
949	S	53.9	Low	39.9	Very low	71 Å²	71	123.2 Å²	123.2	50%	0.497	64%	0.635	S	S	.	*			cis	54.3	-167.2	3.8	77.3	0	0	0	0	114.2	R947	R947-S949 WeakPolarHBondContact CG-OG 3.07Å
950	S	52.3	Low	39.1	Very low	41 Å²	41	123.9 Å²	123.9	29%	0.287	64%	0.636	S	S	.	*			cis	-158.5	179	-4.8	20.5	0	0	0	0	108.4	N953	S950-N953 WeakPolarHBondContact CA-OD1 3.19Å; S950-N953 WeakPolarHBondContact CB-OD1 3.3Å
951	Q	47.3	Very low	38.3	Very low	162 Å²	162	124 Å²	124	76%	0.757	65%	0.649	S	S	*	*	S	Bend	trans	75.2	114.8	-179.8	-52.6	100.5	-111.8	0	0	113.1	N953	Q951-N953 PolarHBondContact N-OD1 3.43Å
952	T	39.2	Very low	37.7	Very low	149 Å²	149	125 Å²	125	91%	0.914	66%	0.661	S	S	*	*	S	Bend	cis	-57.4	143.5	-3.1	-49.5	0	0	0	0	112.5
953	N	36.7	Very low	37.2	Very low	68 Å²	68	123.7 Å²	123.7	36%	0.364	66%	0.66	S	S	.	*			trans	-147.6	150.5	-175.3	-105.5	61.6	0	0	0	107.1	R947 S950 Q951	R947-N953 PolarHBondContact NH2-ND2 3.28Å; S950-N953 WeakPolarHBondContact CA-OD1 3.19Å; S950-N953 WeakPolarHBondContact CB-OD1 3.3Å; Q951-N953 PolarHBondContact N-OD1 3.43Å
954	E	31.8	Very low	36.5	Very low	101 Å²	101	121.7 Å²	121.7	47%	0.472	66%	0.657	S	S	.	*			cis	-154.2	-164.6	-4.4	-153	156.9	-154	0	0	106.6	R947	R947-E954 IonicContact CZ-OE1 3.76Å; R947-E954 IonicContact CZ-OE2 2.7Å; R947-E954 IonicContact NE-OE1 3.13Å; R947-E954 PolarHBondContact NE-OE1 3.48Å; R947-E954 VanDerWaalsContact NH2-CD 3.28Å; R947-E954 IonicContact NH2-OE1 3.32Å; R947-E954 PolarHBondContact NH2-OE1 3.34Å; R947-E954 IonicContact NH2-OE2 3.94Å; R947-E954 PolarHBondContact NH2-OE2 3.21Å
955	H	30.1	Very low	35.8	Very low	156 Å²	156	121.5 Å²	121.5	72%	0.722	66%	0.659	S	S	*	*			trans	70.5	148.5	165.2	-60	-48.6	0	0	0	119
956	D	23	Very low	35	Very low	127 Å²	127	130.3 Å²	130.3	68%	0.679	68%	0.681	S	S	*	*			cis	-161	-169.9	-35.1	-136	-70.8	0	0	0	110.7
957	M	28.8	Very low	34.3	Very low	173 Å²	173	128.8 Å²	128.8	85%	0.852	69%	0.687	S	S	*	*			trans	74	155.6	167.9	-49.9	-172.3	-74.6	0	0	116.8
958	L	26.2	Very low	33.4	Very low	165 Å²	165	127.4 Å²	127.4	86%	0.864	70%	0.7	S	S	*	*			trans	-160.5	150.8	165.3	-127.1	178.7	0	0	0	108.9	P960	L958-P960 WeakPolarHBondContact O-CD 3.03Å
959	I	25.6	Very low	32	Very low	159 Å²	159	129.1 Å²	129.1	82%	0.815	71%	0.709	S	S	*	*			trans	-73.8	121.6	177.8	-58.6	176.5	0	0	0	109.4
960	P	28	Very low	30.7	Very low	120 Å²	120	133 Å²	133	78%	0.779	72%	0.722	S	S	*	*			trans	-85.4	178	-179.6	36.4	-36.9	0	0	0	112.4	L958	L958-P960 WeakPolarHBondContact O-CD 3.03Å
961	G	30.2	Very low	29.4	Very low	75 Å²	75	136.9 Å²	136.9	77%	0.773	75%	0.745	S	S	*	*			trans	142.6	-53.3	160.3	0	0	0	0	0	114.9
962	Q	31.2	Very low	28.5	Very low	174 Å²	174	136 Å²	136	81%	0.813	75%	0.745	S	S	*	*			trans	-71.8	142.3	-173.4	-78.5	-164.4	-26	0	0	114.4
963	P	31.4	Very low	27.9	Very low	119 Å²	119	136.4 Å²	136.4	77%	0.773	74%	0.74	S	S	*	*			trans	-85.2	167.6	152.7	37	-33.4	0	0	0	111.4
964	L	28	Very low	27.3	Very low	135 Å²	135	140.5 Å²	140.5	71%	0.707	76%	0.762	S	S	*	*			trans	-133.7	131.8	-168.8	-63.6	175.5	0	0	0	115.4
965	I	28.7	Very low	27	Very low	133 Å²	133	147 Å²	147	68%	0.682	78%	0.782	S	S	*	*			trans	47.7	125.6	132.7	-51	170	0	0	0	118
966	Y	24.2	Very low	26.7	Very low	227 Å²	227	145 Å²	145	89%	0.89	79%	0.786	S	S	*	*				-176.2	130.8	116.5	-111.5	-85.9	0	0	0	114.3
967	N	30.1	Very low	27	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	79%	0.792	S	S	*	*			trans	-71.9	144.6	167.4	-89.4	-34.2	0	0	0	111.9
968	A	23.5	Very low	26.8	Very low	85 Å²	85	143.3 Å²	143.3	70%	0.702	79%	0.793	S	S	*	*			trans	-178.1	109.6	158.3	0	0	0	0	0	111.6
969	T	22	Very low	26.7	Very low	120 Å²	120	140.1 Å²	140.1	74%	0.736	78%	0.784	S	S	*	*				63.5	94.6	102.5	57.1	0	0	0	0	113.7
970	I	27.4	Very low	26.5	Very low	151 Å²	151	138 Å²	138	77%	0.774	78%	0.783	S	S	*	*			cis	71.6	125	38.2	-46.6	170.4	0	0	0	113.2
971	T	25	Very low	26.3	Very low	124 Å²	124	142.6 Å²	142.6	76%	0.761	79%	0.785	S	S	*	*			trans	-160.1	-163.2	178.1	-0.6	0	0	0	0	107.5
972	N	27.3	Very low	25.9	Very low	142 Å²	142	140.9 Å²	140.9	76%	0.759	77%	0.768	S	S	*	*			cis	-156.6	-155.5	11.2	-148.6	-47.9	0	0	0	109.7
973	I	25.9	Very low	25.5	Very low	159 Å²	159	135.2 Å²	135.2	82%	0.815	75%	0.746	S	S	*	*			trans	88.7	145.3	161.7	-51.4	-178.8	0	0	0	116.9
974	N	25.8	Very low	25	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	73%	0.729	S	S	*	*			trans	-104.2	125.5	-177	-89.4	-28.9	0	0	0	113.5
975	R	25.2	Very low	24.7	Very low	237 Å²	237	129.1 Å²	129.1	89%	0.894	70%	0.701	S	S	*	*				-173.9	124.2	119.1	-103.4	-177.1	-172.8	-170.8	3.4	112.2
976	S	23.5	Very low	24.4	Very low	115 Å²	115	123.4 Å²	123.4	80%	0.804	67%	0.672	S	S	*	*			trans	8.6	142	147.5	58.5	0	0	0	0	121.4
977	G	28.5	Very low	24.3	Very low	78 Å²	78	116.3 Å²	116.3	80%	0.804	65%	0.65	S	S	*	*			trans	146.8	139.4	145.5	0	0	0	0	0	116.8
978	H	26.1	Very low	24	Very low	187 Å²	187	110.7 Å²	110.7	87%	0.866	63%	0.627	S	S	*	*			trans	-67.4	150.4	-165.2	-84.6	-89.2	0	0	0	118.8
979	S	22.6	Very low	24.1	Very low	98 Å²	98	109 Å²	109	69%	0.685	61%	0.61	S	S	*	*			trans	63.5	102	141.3	62.7	0	0	0	0	120.3
980	S	22.2	Very low	24.1	Very low	114 Å²	114	105.1 Å²	105.1	80%	0.797	59%	0.593	S	S	*	*			trans	80.1	-165.5	137.2	84.3	0	0	0	0	120.2	G982	S980-G982 PolarHBondContact O-N 3.46Å; S980-G982 VanDerWaalsContact O-N 3.13Å
981	R	23.1	Very low	24	Very low	216 Å²	216	100.2 Å²	100.2	82%	0.815	57%	0.567	S	S	*	*			trans	53.9	-94.9	-174.1	-63.4	-171.7	173.3	-148.2	-0.2	116.7	R1709	R981-R1709 PolarHBondContact O-NH1 2.96Å
982	G	22	Very low	23.9	Very low	40 Å²	40	96.5 Å²	96.5	41%	0.412	54%	0.54	S	S	.	.			trans	102	-147.5	-131	0	0	0	0	0	110.9	S980 R1709	S980-G982 PolarHBondContact O-N 3.46Å; S980-G982 VanDerWaalsContact O-N 3.13Å; G982-R1709 VanDerWaalsContact CA-NH1 3.27Å
983	P	23.1	Very low	23.7	Very low	54 Å²	54	93.2 Å²	93.2	35%	0.351	52%	0.517	S	S	.	.			cis	-53.4	168	9	-32.3	39.2	0	0	0	117.5	T985 R1709	P983-T985 HydrophobicContact CB-CG2 3.87Å; P983-T985 VanDerWaalsContact CB-N 3.3Å; P983-R1709 WeakPolarHBondContact O-CD 3.22Å; P983-R1709 PolarHBondContact O-NH1 3.5Å
984	Y	22.1	Very low	23.8	Very low	109 Å²	109	89 Å²	89	43%	0.427	50%	0.495	S	S	.	.			cis	75.3	-107.7	23.5	-66.8	-82.9	0	0	0	114.9	N1703 R1709 N1710 E1712	Y984-N1703 WeakPolarHBondContact CB-OD1 2.78Å; Y984-R1709 VanDerWaalsContact CG-NH2 3.28Å; Y984-R1709 VanDerWaalsContact CZ-NH2 3.26Å; Y984-R1709 VanDerWaalsContact N-CZ 3.34Å; Y984-N1710 HydrophobicContact CD1-CB 3.73Å; Y984-N1710 WeakPolarHBondContact CD1-OD1 3.4Å; Y984-N1710 HydrophobicContact CE1-CB 4.49Å; Y984-N1710 HydrophobicContact CG-CB 4.48Å; Y984-N1710 PolarHBondContact O-N 3.18Å; Y984-E1712 WeakPolarHBondContact CE1-OE2 3.35Å
985	T	21.2	Very low	23.8	Very low	17 Å²	17	83.8 Å²	83.8	10%	0.104	47%	0.469	C	S	.	.			trans	85.8	142.6	161.6	178.7	0	0	0	0	120.4	P983 N1703 C1705 A1706 S1707	P983-T985 HydrophobicContact CB-CG2 3.87Å; P983-T985 VanDerWaalsContact CB-N 3.3Å; T985-N1703 CarbonylContact C-O 3.57Å; T985-N1703 WeakPolarHBondContact CA-O 3.37Å; T985-N1703 WeakPolarHBondContact CA-OD1 3.47Å; T985-N1703 WeakPolarHBondContact CB-O 3.43Å; T985-N1703 PolarHBondContact N-OD1 2.94Å; T985-N1703 PolarHBondContact OG1-O 3.37Å; T985-C1705 PolarHBondContact OG1-N 2.87Å; T985-A1706 WeakPolarHBondContact CG2-O 3.48Å; T985-A1706 PolarHBondContact OG1-N 3.13Å; T985-A1706 PolarHBondContact OG1-O 3.46Å; T985-A1706 VanDerWaalsContact OG1-O 3.08Å; T985-S1707 WeakPolarHBondContact O-CA 3.35Å; T985-S1707 WeakPolarHBondContact O-CB 3.48Å; T985-S1707 PolarHBondContact O-OG 3.23Å
986	S	21.2	Very low	23.8	Very low	13 Å²	13	74.1 Å²	74.1	9%	0.091	44%	0.443	C	S	.	.			trans	-145.5	140.8	-158.1	61.8	0	0	0	0	113.6	A1700 N1703 Q1704	S986-A1700 VanDerWaalsContact OG-CA 3.24Å; S986-A1700 WeakPolarHBondContact OG-CA 3.45Å; S986-A1700 PolarHBondContact OG-O 3.02Å; S986-N1703 PolarHBondContact N-O 2.99Å; S986-N1703 WeakPolarHBondContact OG-CB 3.22Å; S986-N1703 PolarHBondContact OG-O 3.37Å; S986-Q1704 CarbonylContact O-C 3.6Å; S986-Q1704 PolarHBondContact O-NE2 2.9Å
987	L	22.8	Very low	23.8	Very low	79 Å²	79	76.4 Å²	76.4	41%	0.414	43%	0.434	S	S	.	.			cis	-84.8	-177.4	5.7	-89.9	49.9	0	0	0	111.8	P989 L1438 A1700 S1707	L987-P989 WeakPolarHBondContact CB-O 3.38Å; L987-P989 WeakPolarHBondContact CD2-O 3.29Å; L987-P989 WeakPolarHBondContact CG-O 3.28Å; L987-L1438 HydrophobicContact CD2-CD2 3.73Å; L987-A1700 HydrophobicContact CD1-CB 4.37Å; L987-S1707 WeakPolarHBondContact O-CB 3.24Å
988	G	24.2	Very low	23.6	Very low	33 Å²	33	75.7 Å²	75.7	34%	0.34	42%	0.42	S	S	.	.			cis	-62.4	170.2	10.7	0	0	0	0	0	117.1	T1713	G988-T1713 WeakPolarHBondContact O-CB 3.28Å; G988-T1713 PolarHBondContact O-OG1 3.36Å
989	P	24.9	Very low	23.5	Very low	51 Å²	51	71.5 Å²	71.5	33%	0.331	41%	0.41	S	S	.	.			cis	-67.1	174.4	9.2	-24.4	37.6	0	0	0	115.9	L987 H991	L987-P989 WeakPolarHBondContact CB-O 3.38Å; L987-P989 WeakPolarHBondContact CD2-O 3.29Å; L987-P989 WeakPolarHBondContact CG-O 3.28Å; P989-H991 HydrophobicContact CB-CB 4.16Å
990	G	22.7	Very low	23.6	Very low	37 Å²	37	69.5 Å²	69.5	38%	0.381	39%	0.391	S	S	.	.			cis	-64.5	167.3	6.9	0	0	0	0	0	116.9
991	H	24.6	Very low	23.6	Very low	49 Å²	49	66.7 Å²	66.7	23%	0.227	38%	0.375	C	S	.	.			cis	60.8	171.9	-3.2	-56.5	-125.3	0	0	0	116.6	P989 W1435 S1439 H1680	P989-H991 HydrophobicContact CB-CB 4.16Å; H991-W1435 HydrophobicContact CB-CZ2 3.75Å; H991-S1439 PolarHBondContact O-OG 3.35Å; H991-H1680 AromaticContact CE1-CE1 3.8Å; H991-H1680 AromaticContact CE1-NE2 3.9Å; H991-H1680 AromaticContact CG-NE2 3.81Å; H991-H1680 AromaticContact ND1-CD2 3.5Å; H991-H1680 AromaticContact ND1-CE1 3.22Å; H991-H1680 PolarHBondContact ND1-CE1 2.86Å; H991-H1680 AromaticContact ND1-CG 3.99Å; H991-H1680 AromaticContact ND1-ND1 3.8Å; H991-H1680 AromaticContact ND1-NE2 2.91Å; H991-H1680 PolarHBondContact ND1-NE2 2.85Å
992	F	23.7	Very low	23.8	Very low	45 Å²	45	60.3 Å²	60.3	20%	0.197	35%	0.352	C	S	.	.			trans	-161.2	170.4	-179.6	-116.2	-55.5	0	0	0	113.1	S1439 I1441	F992-S1439 WeakPolarHBondContact CE2-O 3.48Å; F992-S1439 WeakPolarHBondContact CZ-O 3.32Å; F992-I1441 HydrophobicContact CE1-CB 3.76Å; F992-I1441 HydrophobicContact CE1-CD1 3.96Å; F992-I1441 HydrophobicContact CE1-CG1 4.08Å; F992-I1441 HydrophobicContact CE2-CD1 3.76Å; F992-I1441 HydrophobicContact CE2-CG1 4.16Å; F992-I1441 HydrophobicContact CZ-CB 3.62Å; F992-I1441 HydrophobicContact CZ-CD1 3.43Å; F992-I1441 VanDerWaalsContact CZ-CD1 3.43Å; F992-I1441 HydrophobicContact CZ-CG1 3.46Å; F992-I1441 VanDerWaalsContact CZ-CG1 3.46Å
993	R	23.4	Very low	23.8	Very low	74 Å²	74	59.6 Å²	59.6	28%	0.279	34%	0.338	S	S	.	.			trans	-149.6	104.5	172.1	-153.2	-179.3	-166.8	179.5	-2.9	108.1	W1435 D1677	R993-W1435 HydrophobicContact CB-CH2 4.36Å; R993-W1435 HydrophobicContact CB-CZ3 3.96Å; R993-D1677 WeakPolarHBondContact CG-OD1 3.23Å; R993-D1677 VanDerWaalsContact CZ-CG 3.44Å; R993-D1677 IonicContact CZ-OD1 2.87Å; R993-D1677 IonicContact CZ-OD2 3.77Å; R993-D1677 VanDerWaalsContact CZ-OD2 3.3Å; R993-D1677 IonicContact NE-OD1 2.71Å; R993-D1677 PolarHBondContact NE-OD1 3Å; R993-D1677 IonicContact NE-OD2 3.85Å; R993-D1677 PolarHBondContact NE-OD2 3.36Å; R993-D1677 VanDerWaalsContact NH2-CB 3.32Å; R993-D1677 IonicContact NH2-OD1 3.66Å; R993-D1677 IonicContact NH2-OD2 2.97Å; R993-D1677 PolarHBondContact NH2-OD2 3.42Å
994	I	26.8	Very low	23.9	Very low	71 Å²	71	59.7 Å²	59.7	36%	0.364	34%	0.343	S	S	.	.			trans	-120.9	114.1	163.5	-63.4	178.3	0	0	0	106.4	G996 I1441 T1445	I994-G996 PolarHBondContact O-N 2.97Å; I994-I1441 HydrophobicContact CD1-CB 4.45Å; I994-I1441 HydrophobicContact CD1-CD1 3.64Å; I994-I1441 HydrophobicContact CD1-CG2 3.91Å; I994-T1445 HydrophobicContact CD1-CG2 4.3Å; I994-T1445 HydrophobicContact CG1-CG2 4.09Å; I994-T1445 HydrophobicContact CG2-CG2 3.83Å
995	T	26.6	Very low	24	Very low	42 Å²	42	61 Å²	61	26%	0.258	36%	0.363	S	S	.	.			trans	-60.9	127.2	175.2	41.2	0	0	0	0	109.2	R997 D1449	T995-R997 PolarHBondContact O-N 3.48Å; T995-D1449 HydrophobicContact CG2-CB 4.41Å; T995-D1449 WeakPolarHBondContact CG2-OD2 3.4Å
996	G	25.3	Very low	24	Very low	35 Å²	35	65.2 Å²	65.2	36%	0.361	39%	0.393	S	S	.	.			trans	-58.1	111	179.1	0	0	0	0	0	110.3	I994 A998	I994-G996 PolarHBondContact O-N 2.97Å; G996-A998 PolarHBondContact O-N 2.69Å
997	R	23.9	Very low	24.1	Very low	163 Å²	163	73.3 Å²	73.3	62%	0.615	43%	0.432	S	S	*	.			trans	-74.3	108.1	166.6	-137.3	176.6	-171.9	-162.5	-4.1	107.2	T789 T995 P999 Q1265	T789-R997 PolarHBondContact OG1-NH2 3.18Å; T995-R997 PolarHBondContact O-N 3.48Å; R997-P999 WeakPolarHBondContact O-CD 3.36Å; R997-Q1265 PolarHBondContact O-NE2 3.36Å
998	A	23.5	Very low	24.1	Very low	62 Å²	62	72.6 Å²	72.6	51%	0.512	44%	0.444	S	S	.	.			trans	-65	125.8	161.4	0	0	0	0	0	108.7	G996 L1000	G996-A998 PolarHBondContact O-N 2.69Å; A998-L1000 PolarHBondContact O-N 3.45Å
999	P	23.5	Very low	24.1	Very low	99 Å²	99	77.2 Å²	77.2	64%	0.643	47%	0.466	S	S	*	.			trans	-83.8	99.5	165.9	30.4	-24.3	0	0	0	108.2	R997	R997-P999 WeakPolarHBondContact O-CD 3.36Å
1000	L	24.6	Very low	24.1	Very low	56 Å²	56	80 Å²	80	29%	0.293	48%	0.482	S	S	.	.			trans	-75.3	138.8	166.1	-91.8	163.8	0	0	0	111	R790 A998 K1534 N1538	R790-L1000 PolarHBondContact NH1-O 3.44Å; A998-L1000 PolarHBondContact O-N 3.45Å; L1000-K1534 HydrophobicContact CD1-CB 4.27Å; L1000-K1534 HydrophobicContact CD1-CD 4.21Å; L1000-K1534 HydrophobicContact CD1-CG 3.57Å; L1000-K1534 HydrophobicContact CD2-CB 4.28Å; L1000-K1534 HydrophobicContact CD2-CD 3.46Å; L1000-K1534 VanDerWaalsContact CD2-CD 3.46Å; L1000-K1534 HydrophobicContact CD2-CG 3.7Å; L1000-K1534 HydrophobicContact CG-CD 4.1Å; L1000-K1534 HydrophobicContact CG-CG 4.02Å; L1000-N1538 WeakPolarHBondContact CD2-OD1 3.43Å
1001	A	23.4	Very low	24.2	Very low	56 Å²	56	84.6 Å²	84.6	46%	0.463	50%	0.502	S	S	.	.			trans	-111.1	49.1	-161.8	0	0	0	0	0	114.1	R794	R794-A1001 PolarHBondContact NH2-O 2.7Å
1002	Y	26.6	Very low	24.5	Very low	82 Å²	82	88.5 Å²	88.5	32%	0.322	53%	0.532	S	S	.	.			trans	-98.3	139.2	169.4	-90.3	-144.8	0	0	0	111	R790 R794 N1538 D1539	R790-Y1002 WeakPolarHBondContact CD-O 3.26Å; R790-Y1002 PolarHBondContact NE-O 3Å; R794-Y1002 VanDerWaalsContact NH2-CD2 3.35Å; Y1002-N1538 HydrophobicContact CD1-CB 3.85Å; Y1002-N1538 WeakPolarHBondContact CD1-O 3.27Å; Y1002-N1538 HydrophobicContact CE1-CB 3.57Å; Y1002-N1538 VanDerWaalsContact CE1-O 3.28Å; Y1002-N1538 WeakPolarHBondContact CE1-O 3.45Å; Y1002-N1538 HydrophobicContact CE2-CB 4.31Å; Y1002-N1538 HydrophobicContact CG-CB 4.31Å; Y1002-D1539 WeakPolarHBondContact CE1-OD1 3.37Å; Y1002-D1539 VanDerWaalsContact CZ-OD1 3.24Å; Y1002-D1539 PolarHBondContact OH-OD1 3.24Å
1003	D	21.9	Very low	24.5	Very low	25 Å²	25	94.1 Å²	94.1	13%	0.134	56%	0.563	C	S	.	*			trans	-153.5	160.8	-167.4	-69.1	104.5	0	0	0	108.3	R790 I792 R794	R790-D1003 IonicContact CZ-OD1 2.64Å; R790-D1003 VanDerWaalsContact CZ-OD1 3.24Å; R790-D1003 IonicContact CZ-OD2 3.6Å; R790-D1003 VanDerWaalsContact NE-CG 3.25Å; R790-D1003 IonicContact NE-OD1 2.94Å; R790-D1003 PolarHBondContact NE-OD1 2.64Å; R790-D1003 VanDerWaalsContact NE-OD1 3.1Å; R790-D1003 IonicContact NE-OD2 2.91Å; R790-D1003 PolarHBondContact NE-OD2 3.47Å; R790-D1003 IonicContact NH2-OD1 2.77Å; R790-D1003 PolarHBondContact NH2-OD1 2.89Å; R790-D1003 IonicContact NH2-OD2 3.87Å; I792-D1003 HydrophobicContact CB-CB 4.47Å; I792-D1003 HydrophobicContact CG1-CB 3.68Å; I792-D1003 VanDerWaalsContact CG1-OD2 3.23Å; I792-D1003 WeakPolarHBondContact CG1-OD2 3.39Å; I792-D1003 HydrophobicContact CG2-CB 4.26Å; R794-D1003 HydrophobicContact CB-CB 3.8Å; R794-D1003 WeakPolarHBondContact CD-O 3.16Å; R794-D1003 HydrophobicContact CG-CB 3.75Å; R794-D1003 PolarHBondContact NH1-O 2.6Å
1004	A	24.2	Very low	24.6	Very low	55 Å²	55	98 Å²	98	46%	0.455	58%	0.584	S	S	.	*			trans	-125	-164.4	-166.4	0	0	0	0	0	114.9	I792	I792-A1004 HydrophobicContact CD1-CB 3.87Å
1005	T	25	Very low	24.9	Very low	136 Å²	136	99 Å²	99	83%	0.834	60%	0.597	S	S	*	*			trans	-123.7	146.1	-160.8	28.7	0	0	0	0	111.8
1006	S	21.3	Very low	25.1	Very low	106 Å²	106	101.3 Å²	101.3	74%	0.741	61%	0.613	S	S	*	*			trans	-63.5	144.8	156.3	52	0	0	0	0	111.9
1007	M	22.8	Very low	25	Very low	183 Å²	183	109 Å²	109	90%	0.901	64%	0.636	S	S	*	*			trans	156	120.3	133.6	-86.5	-74.9	-140	0	0	111.6
1008	G	23.7	Very low	25	Very low	65 Å²	65	106.2 Å²	106.2	67%	0.67	64%	0.64	S	S	*	*			trans	64.4	150	150.9	0	0	0	0	0	116.8
1009	T	23.4	Very low	24.9	Very low	130 Å²	130	110.5 Å²	110.5	80%	0.798	65%	0.652	S	S	*	*			cis	155.8	138.6	23.7	25.6	0	0	0	0	100.4
1010	T	25.1	Very low	25	Very low	110 Å²	110	112.5 Å²	112.5	68%	0.675	66%	0.656	S	S	*	*			cis	171.5	131	20	22.6	0	0	0	0	106.6
1011	T	25	Very low	25.1	Very low	132 Å²	132	115.4 Å²	115.4	81%	0.81	67%	0.672	S	S	*	*			trans	67.3	148.1	140.6	61.9	0	0	0	0	120.8
1012	P	30.1	Very low	25.2	Very low	131 Å²	131	118.4 Å²	118.4	85%	0.851	68%	0.68	S	S	*	*			cis	-132.1	-141.5	29	43.4	-24.4	0	0	0	114.8
1013	I	25.1	Very low	25.2	Very low	163 Å²	163	119.3 Å²	119.3	84%	0.836	69%	0.694	S	S	*	*			trans	-160.7	168.2	-171.2	-162.2	164	0	0	0	113.7
1014	Q	25.3	Very low	25.4	Very low	156 Å²	156	124.4 Å²	124.4	73%	0.729	72%	0.721	S	S	*	*			trans	120.9	156	169	-65.8	-142.4	53.7	0	0	114.9
1015	S	33.5	Very low	25.6	Very low	91 Å²	91	129.7 Å²	129.7	64%	0.636	74%	0.736	S	S	*	*			cis	77.6	145.4	30.5	148.2	0	0	0	0	113.7
1016	P	29	Very low	25.5	Very low	91 Å²	91	131.4 Å²	131.4	59%	0.591	73%	0.732	S	S	*	*			cis	-149.6	177.8	37.4	45.9	-26.4	0	0	0	120.6
1017	K	23.5	Very low	25.7	Very low	196 Å²	196	129.3 Å²	129.3	85%	0.852	72%	0.718	S	S	*	*			trans	86.1	-138.5	146.2	-71.9	154.9	-171	172.1	0	121.6
1018	P	24.1	Very low	25.8	Very low	106 Å²	106	130.6 Å²	130.6	69%	0.688	72%	0.719	S	S	*	*				-132.5	178	-107	42.9	-28.4	0	0	0	120.2
1019	I	22.3	Very low	25.7	Very low	152 Å²	152	132.1 Å²	132.1	78%	0.779	71%	0.711	S	S	*	*	S	Bend	trans	-49.7	142.3	147.3	-64.5	164.4	0	0	0	109.5
1020	I	24.9	Very low	25.9	Very low	140 Å²	140	132 Å²	132	72%	0.718	71%	0.706	S	S	*	*			trans	69.8	141.9	167.6	-83.5	170.6	0	0	0	115.3
1021	N	26.3	Very low	26	Very low	117 Å²	117	134.3 Å²	134.3	63%	0.626	71%	0.709	S	S	*	*			cis	-133.9	169.1	3.9	-146.3	54.6	0	0	0	113.4
1022	D	26.4	Very low	26.4	Very low	120 Å²	120	134.6 Å²	134.6	64%	0.642	70%	0.701	S	S	*	*			trans	66	149.6	169.8	-71	-58.5	0	0	0	118.5
1023	T	26.4	Very low	26.6	Very low	100 Å²	100	134.3 Å²	134.3	61%	0.613	70%	0.696	S	S	*	*			cis	85.2	127.4	26.4	-17.4	0	0	0	0	115.5
1024	L	26.2	Very low	26.8	Very low	132 Å²	132	133.1 Å²	133.1	69%	0.691	69%	0.687	S	S	*	*			trans	78	54.7	167.8	-49.2	168.8	0	0	0	114.8	F1026	L1024-F1026 VanDerWaalsContact C-N 3.3Å; L1024-F1026 HydrophobicContact CB-CE2 4.5Å
1025	Q	27.7	Very low	26.9	Very low	166 Å²	166	134.6 Å²	134.6	78%	0.776	69%	0.686	S	S	*	*			cis	61.2	26.6	44.6	-156.1	-126.1	-99.4	0	0	114.6
1026	F	24	Very low	26.6	Very low	172 Å²	172	137.6 Å²	137.6	75%	0.754	70%	0.695	S	S	*	*			trans	-76.9	127.4	155	-70	-88.6	0	0	0	108.4	L1024	L1024-F1026 VanDerWaalsContact C-N 3.3Å; L1024-F1026 HydrophobicContact CB-CE2 4.5Å
1027	S	25	Very low	26.3	Very low	62 Å²	62	136.8 Å²	136.8	43%	0.434	69%	0.692	S	S	.	*			cis	83.7	107.1	16.4	-140	0	0	0	0	114.4	D1029	S1027-D1029 PolarHBondContact OG-OD1 2.85Å
1028	F	25	Very low	26.2	Very low	211 Å²	211	133.3 Å²	133.3	93%	0.925	69%	0.687	S	S	*	*	S	Bend	trans	-174	81.3	157.2	-100.6	-60.9	0	0	0	110.2
1029	D	21	Very low	26	Very low	96 Å²	96	136.7 Å²	136.7	51%	0.513	70%	0.698	S	S	.	*			cis	-154.5	-147.9	-15.9	-151.3	73	0	0	0	110.6	S1027 E1031	S1027-D1029 PolarHBondContact OG-OD1 2.85Å; D1029-E1031 PolarHBondContact O-N 2.83Å
1030	N	28	Very low	26	Very low	128 Å²	128	136.3 Å²	136.3	68%	0.684	70%	0.696	S	S	*	*			trans	-73.7	43.2	-172.3	-75.5	-96.9	0	0	0	116	H1032	N1030-H1032 PolarHBondContact O-ND1 2.72Å; N1030-H1032 VanDerWaalsContact O-ND1 3.13Å
1031	E	26.7	Very low	25.8	Very low	159 Å²	159	133.6 Å²	133.6	74%	0.743	69%	0.69	S	S	*	*			trans	-80.7	121.1	179.2	-80.6	-80.2	176.6	0	0	112.8	D1029	D1029-E1031 PolarHBondContact O-N 2.83Å
1032	H	32.9	Very low	25.7	Very low	137 Å²	137	133.1 Å²	133.1	63%	0.634	70%	0.695	S	S	*	*			cis	-158.5	129.6	-28.4	-118.4	-26.4	0	0	0	109.4	N1030	N1030-H1032 PolarHBondContact O-ND1 2.72Å; N1030-H1032 VanDerWaalsContact O-ND1 3.13Å
1033	V	35	Very low	25.8	Very low	125 Å²	125	134 Å²	134	76%	0.758	70%	0.699	S	S	*	*			trans	86.1	133.5	139.5	-178.8	0	0	0	0	118.7
1034	Q	29.6	Very low	25.9	Very low	139 Å²	139	134.3 Å²	134.3	65%	0.65	70%	0.702	S	S	*	*			cis	-169.1	154.3	-24.4	-170.4	-158.7	111	0	0	108.5
1035	R	26.7	Very low	25.8	Very low	187 Å²	187	131.9 Å²	131.9	71%	0.706	69%	0.69	S	S	*	*			trans	69.7	148.8	164.1	-98.8	-171.3	164.7	85.1	-4.6	117.1	S1037	R1035-S1037 PolarHBondContact NE-OG 3.05Å; R1035-S1037 VanDerWaalsContact NE-OG 3.15Å
1036	N	27.3	Very low	25.4	Very low	154 Å²	154	129.1 Å²	129.1	82%	0.824	68%	0.677	S	S	*	*			cis	80.3	160.6	-5.6	-137.5	-53.7	0	0	0	119.6
1037	S	23.2	Very low	25.1	Very low	74 Å²	74	130.2 Å²	130.2	52%	0.517	68%	0.681	S	S	.	*			trans	63.2	153.7	-169.1	76.3	0	0	0	0	114.5	R1035	R1035-S1037 PolarHBondContact NE-OG 3.05Å; R1035-S1037 VanDerWaalsContact NE-OG 3.15Å
1038	V	22.3	Very low	25	Very low	123 Å²	123	131 Å²	131	75%	0.745	69%	0.687	S	S	*	*			cis	-170.4	142.1	-16.8	134.4	0	0	0	0	101.2	I1040	V1038-I1040 PolarHBondContact O-N 2.73Å
1039	L	19.5	Very low	25	Very low	177 Å²	177	124.7 Å²	124.7	93%	0.927	66%	0.663	S	S	*	*			trans	-68.2	108.6	-161.2	-159.9	174.6	0	0	0	112.7
1040	I	21.9	Very low	25.3	Very low	143 Å²	143	126.8 Å²	126.8	73%	0.733	67%	0.667	S	S	*	*			trans	-163.1	153.4	-177.9	-113.6	165	0	0	0	106.4	V1038	V1038-I1040 PolarHBondContact O-N 2.73Å
1041	S	21.5	Very low	25.3	Very low	84 Å²	84	126.2 Å²	126.2	59%	0.587	67%	0.671	S	S	*	*			cis	175	138.7	-26.8	58.2	0	0	0	0	106.1
1042	S	24.4	Very low	25.2	Very low	106 Å²	106	124.4 Å²	124.4	74%	0.741	67%	0.67	S	S	*	*			trans	62.7	148.8	-173.7	78.2	0	0	0	0	115.2
1043	I	28.3	Very low	24.9	Very low	140 Å²	140	124 Å²	124	72%	0.718	67%	0.672	S	S	*	*			cis	78.6	61.3	6.1	-34	177.9	0	0	0	118.4	N1045	I1043-N1045 PolarHBondContact O-ND2 3.39Å
1044	P	27.6	Very low	24.4	Very low	106 Å²	106	124.8 Å²	124.8	69%	0.688	67%	0.666	S	S	*	*			trans	-62.1	152.1	142.4	-12.7	29.3	0	0	0	110.5
1045	N	24.8	Very low	24.1	Very low	80 Å²	80	125.8 Å²	125.8	43%	0.428	67%	0.67	S	S	.	*			cis	69.9	174.7	2.8	-64.7	-69.7	0	0	0	117.6	Y897 H898 I1043	Y897-N1045 VanDerWaalsContact C-OD1 3.25Å; Y897-N1045 PolarHBondContact O-ND2 3.31Å; Y897-N1045 PolarHBondContact O-OD1 2.73Å; H898-N1045 PolarHBondContact N-OD1 2.53Å; I1043-N1045 PolarHBondContact O-ND2 3.39Å
1046	E	18.9	Very low	23.9	Very low	108 Å²	108	121.9 Å²	121.9	51%	0.505	66%	0.663	S	S	.	*			trans	-49.7	150.2	-166.9	-77.7	-62.7	110.9	0	0	115.2	S1048 N1049	E1046-S1048 WeakPolarHBondContact OE2-CA 3.42Å; E1046-S1048 WeakPolarHBondContact OE2-CB 3.23Å; E1046-N1049 WeakPolarHBondContact OE1-CB 3.35Å; E1046-N1049 PolarHBondContact OE1-ND2 2.67Å
1047	K	18.5	Very low	23.9	Very low	195 Å²	195	122.4 Å²	122.4	85%	0.848	66%	0.661	S	S	*	*	S	Bend	cis	-130.3	164	26.2	-80.5	-173.6	178.1	-178.1	0	113.2
1048	S	22	Very low	24	Very low	78 Å²	78	124 Å²	124	55%	0.545	67%	0.668	S	S	.	*			cis	-166	121	-17.2	55.3	0	0	0	0	105.4	E1046 K1050	E1046-S1048 WeakPolarHBondContact OE2-CA 3.42Å; E1046-S1048 WeakPolarHBondContact OE2-CB 3.23Å; S1048-K1050 VanDerWaalsContact C-N 3.31Å
1049	N	24.9	Very low	24.3	Very low	79 Å²	79	124.3 Å²	124.3	42%	0.422	66%	0.664	S	S	.	*	S	Bend	cis	66.3	22.9	39.3	-139.1	-4.2	0	0	0	114.2	E1046	E1046-N1049 WeakPolarHBondContact OE1-CB 3.35Å; E1046-N1049 PolarHBondContact OE1-ND2 2.67Å
1050	K	26.6	Very low	25	Very low	140 Å²	140	121.7 Å²	121.7	61%	0.609	65%	0.651	S	S	*	*			trans	65.5	173.6	177.2	-38.5	135.7	-99.6	100	0	111	S1048 V1052	S1048-K1050 VanDerWaalsContact C-N 3.31Å; K1050-V1052 HydrophobicContact CB-CG2 4.45Å
1051	P	28.7	Very low	25.3	Very low	116 Å²	116	123.6 Å²	123.6	75%	0.753	65%	0.654	S	S	*	*			cis	-74.6	176.8	-6.2	41.7	-42.2	0	0	0	111.2
1052	V	24.6	Very low	25.5	Very low	122 Å²	122	124.8 Å²	124.8	74%	0.739	66%	0.66	S	S	*	*			cis	81.6	140.5	16.7	-177.9	0	0	0	0	112.8	K1050	K1050-V1052 HydrophobicContact CB-CG2 4.45Å
1053	L	26.4	Very low	25.7	Very low	129 Å²	129	123.8 Å²	123.8	68%	0.675	65%	0.653	S	S	*	*			cis	-124	-47.4	-0.8	-177.5	61.5	0	0	0	113.4
1054	F	24.8	Very low	25.7	Very low	140 Å²	140	128.5 Å²	128.5	61%	0.614	66%	0.661	S	S	*	*			trans	-144.7	175.3	-168.2	-67	144.7	0	0	0	108.2	D1056	F1054-D1056 HydrophobicContact CD2-CB 4.09Å
1055	E	23.3	Very low	25.8	Very low	160 Å²	160	128.3 Å²	128.3	75%	0.748	66%	0.662	S	S	*	*			cis	-105.5	150.8	-5.7	-73.2	67.3	-140.3	0	0	110.6
1056	D	23.1	Very low	26	Very low	105 Å²	105	129.5 Å²	129.5	56%	0.561	68%	0.676	S	S	*	*			cis	76.2	24.1	11.6	-141	54.2	0	0	0	117.5	F1054 T1058	F1054-D1056 HydrophobicContact CD2-CB 4.09Å; D1056-T1058 PolarHBondContact O-N 2.82Å; D1056-T1058 PolarHBondContact O-OG1 3.4Å; D1056-T1058 WeakPolarHBondContact OD1-CG2 3.33Å
1057	E	26.1	Very low	26.5	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	70%	0.695	S	S	*	*			trans	-69.4	81.5	162.5	-82	-160	145.3	0	0	110.2	I1059	E1057-I1059 HydrophobicContact CB-CD1 4.3Å; E1057-I1059 HydrophobicContact CB-CG1 4.31Å; E1057-I1059 PolarHBondContact O-N 2.85Å
1058	T	25.9	Very low	27.1	Very low	108 Å²	108	130.3 Å²	130.3	66%	0.663	69%	0.689	S	S	*	*			trans	-83.1	57.2	-173.9	41.9	0	0	0	0	112.3	D1056 N1060	D1056-T1058 PolarHBondContact O-N 2.82Å; D1056-T1058 PolarHBondContact O-OG1 3.4Å; D1056-T1058 WeakPolarHBondContact OD1-CG2 3.33Å; T1058-N1060 PolarHBondContact O-N 2.82Å
1059	I	29.2	Very low	27.5	Very low	128 Å²	128	130 Å²	130	66%	0.656	69%	0.687	S	S	*	*			trans	-71.6	94.2	-171.6	-57.4	174.3	0	0	0	111.3	E1057	E1057-I1059 HydrophobicContact CB-CD1 4.3Å; E1057-I1059 HydrophobicContact CB-CG1 4.31Å; E1057-I1059 PolarHBondContact O-N 2.85Å
1060	N	33.5	Very low	27.8	Very low	122 Å²	122	131.4 Å²	131.4	65%	0.652	70%	0.702	S	S	*	*			trans	73	151.8	176.6	-66.3	-69.3	0	0	0	114.2	T1058	T1058-N1060 PolarHBondContact O-N 2.82Å
1061	K	27.7	Very low	28.3	Very low	183 Å²	183	128.3 Å²	128.3	80%	0.796	69%	0.691	S	S	*	*			cis	68.4	151.1	37.8	-66.3	173.8	178.2	168.8	0	113.1
1062	P	27.2	Very low	28.4	Very low	110 Å²	110	130.1 Å²	130.1	71%	0.714	69%	0.689	S	S	*	*			cis	-128.5	-168.7	-17.6	25.4	-1.6	0	0	0	111.8
1063	S	27	Very low	28.6	Very low	85 Å²	85	132.8 Å²	132.8	59%	0.594	69%	0.686	S	S	*	*			trans	73.4	120.4	132.7	51.5	0	0	0	0	119.7
1064	R	28.2	Very low	28.9	Very low	238 Å²	238	134.9 Å²	134.9	90%	0.898	70%	0.696	S	S	*	*				57.9	133.7	74.1	-57.7	166.2	167.8	-166.6	-3.4	110.3
1065	S	29.6	Very low	29.1	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	71%	0.707	S	S	*	*			cis	-150.4	168.1	15	-32.9	0	0	0	0	107.8
1066	C	29.6	Very low	29.3	Very low	106 Å²	106	132.1 Å²	132.1	72%	0.716	71%	0.706	S	S	*	*			cis	65.7	52.5	22.6	-166.8	0	0	0	0	114.6	M1068	C1066-M1068 VanDerWaalsContact C-N 3.28Å; C1066-M1068 PolarHBondContact O-N 2.79Å
1067	L	29.4	Very low	29.5	Very low	170 Å²	170	136.5 Å²	136.5	89%	0.89	72%	0.721	S	S	*	*			trans	-75	87.3	163.3	-137.9	140.8	0	0	0	106.7
1068	M	31.4	Very low	29.7	Very low	149 Å²	149	130.9 Å²	130.9	73%	0.734	70%	0.7	S	S	*	*				77.7	126.7	90.8	-82.9	-82.2	-160.9	0	0	108.4	C1066	C1066-M1068 VanDerWaalsContact C-N 3.28Å; C1066-M1068 PolarHBondContact O-N 2.79Å
1069	S	31.5	Very low	29.8	Very low	72 Å²	72	131.9 Å²	131.9	50%	0.503	71%	0.711	S	S	.	*			cis	-176	104.5	8.3	-175.4	0	0	0	0	102.2
1070	C	31	Very low	29.8	Very low	108 Å²	108	136.8 Å²	136.8	73%	0.73	72%	0.721	S	S	*	*	S	Bend	trans	-149.6	53.8	166.6	-118.8	0	0	0	0	111.1	Q1072	C1070-Q1072 PolarHBondContact O-N 2.78Å; C1070-Q1072 VanDerWaalsContact O-N 3.12Å
1071	I	37.1	Very low	29.6	Very low	76 Å²	76	138.1 Å²	138.1	39%	0.39	73%	0.728	S	S	.	*				58.8	53.6	117.6	-50.6	154.5	0	0	0	109.3	R1073	I1071-R1073 HydrophobicContact CG2-CG 4.14Å; I1071-R1073 VanDerWaalsContact CG2-CZ 3.43Å; I1071-R1073 WeakPolarHBondContact O-CD 3.29Å; I1071-R1073 VanDerWaalsContact O-CG 3.24Å; I1071-R1073 WeakPolarHBondContact O-CG 3.42Å; I1071-R1073 PolarHBondContact O-NH1 2.74Å
1072	Q	29.5	Very low	29.4	Very low	153 Å²	153	139.3 Å²	139.3	72%	0.715	73%	0.733	S	S	*	*				51	76.9	70.1	-56.4	154.9	-96.4	0	0	108.4	C1070	C1070-Q1072 PolarHBondContact O-N 2.78Å; C1070-Q1072 VanDerWaalsContact O-N 3.12Å
1073	R	28.4	Very low	29.3	Very low	179 Å²	179	145.3 Å²	145.3	68%	0.675	74%	0.742	S	S	*	*			trans	-138.5	-54	-164.3	-79.9	163.9	174.7	120.8	-14.1	115.1	I1071 T1075	I1071-R1073 HydrophobicContact CG2-CG 4.14Å; I1071-R1073 VanDerWaalsContact CG2-CZ 3.43Å; I1071-R1073 WeakPolarHBondContact O-CD 3.29Å; I1071-R1073 VanDerWaalsContact O-CG 3.24Å; I1071-R1073 WeakPolarHBondContact O-CG 3.42Å; I1071-R1073 PolarHBondContact O-NH1 2.74Å; R1073-T1075 PolarHBondContact O-N 2.75Å
1074	I	32.8	Very low	29	Very low	172 Å²	172	146.3 Å²	146.3	88%	0.882	75%	0.747	S	S	*	*	S	Bend	trans	-85.9	60.9	-166.3	-51.8	176	0	0	0	110.7
1075	T	29.4	Very low	28.8	Very low	136 Å²	136	141 Å²	141	83%	0.834	74%	0.737	S	S	*	*			trans	-147.6	66.3	169	39.7	0	0	0	0	109.5	R1073	R1073-T1075 PolarHBondContact O-N 2.75Å
1076	S	27.5	Very low	28.6	Very low	106 Å²	106	141 Å²	141	74%	0.741	73%	0.733	S	S	*	*			trans	-153.2	23.6	165.4	75.1	0	0	0	0	115.9
1077	F	27.4	Very low	28.3	Very low	197 Å²	197	142.6 Å²	142.6	86%	0.864	73%	0.734	S	S	*	*	S	Bend	trans	-147.1	101.8	175.7	-144.6	-97.8	0	0	0	107.4
1078	C	31.3	Very low	28.1	Very low	49 Å²	49	139.7 Å²	139.7	33%	0.331	72%	0.723	S	S	.	*			cis	-154.9	95.7	22.8	-88.7	0	0	0	0	109.9	R1080 L1081	C1078-R1080 HydrophobicContact CB-CB 4.42Å; C1078-R1080 PolarHBondContact O-N 3.39Å; C1078-L1081 HydrophobicContact CB-CD1 4.17Å; C1078-L1081 HydrophobicContact CB-CG 4.16Å
1079	S	26.6	Very low	27.7	Very low	129 Å²	129	141.4 Å²	141.4	90%	0.902	73%	0.727	S	S	*	*	S	Bend	trans	-68.4	43.3	151.5	39.4	0	0	0	0	111.6
1080	R	29.4	Very low	27.3	Very low	230 Å²	230	146.9 Å²	146.9	87%	0.868	74%	0.741	S	S	*	*			trans	-124.6	25.5	175.4	-78.9	-171	-178.2	173.3	1.6	112	C1078	C1078-R1080 HydrophobicContact CB-CB 4.42Å; C1078-R1080 PolarHBondContact O-N 3.39Å
1081	L	28.9	Very low	27.1	Very low	151 Å²	151	148.2 Å²	148.2	79%	0.791	75%	0.746	S	S	*	*	S	Bend	trans	-120.2	24.9	-171.8	-60.3	174.6	0	0	0	113	C1078	C1078-L1081 HydrophobicContact CB-CD1 4.17Å; C1078-L1081 HydrophobicContact CB-CG 4.16Å
1082	F	25	Very low	26.6	Very low	208 Å²	208	151 Å²	151	91%	0.912	76%	0.761	S	S	*	*	S	Bend	trans	-145.8	41.4	-166	-155.6	-106	0	0	0	114.2
1083	R	23.6	Very low	26.4	Very low	236 Å²	236	153.1 Å²	153.1	89%	0.891	77%	0.768	S	S	*	*			trans	-154.1	124.8	173.6	-156.1	-177.2	-133.7	-162	4	112.4
1084	C	22.4	Very low	26.1	Very low	105 Å²	105	147.7 Å²	147.7	71%	0.709	77%	0.768	S	S	*	*			trans	62.7	152.1	155.2	-81.2	0	0	0	0	115.7
1085	N	23.5	Very low	25.7	Very low	128 Å²	128	146.8 Å²	146.8	68%	0.684	76%	0.764	S	S	*	*			cis	-161.8	155.8	12	-131.8	-0.8	0	0	0	106.9	D1087	N1085-D1087 PolarHBondContact O-N 2.79Å
1086	T	24.2	Very low	25.3	Very low	101 Å²	101	144.4 Å²	144.4	62%	0.62	75%	0.753	S	S	*	*			trans	-18.3	124.4	140.8	52.3	0	0	0	0	114.4
1087	D	23.7	Very low	25.1	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	75%	0.754	S	S	*	*			trans	-176	107.4	133.5	-90.8	-30.6	0	0	0	107.3	N1085	N1085-D1087 PolarHBondContact O-N 2.79Å
1088	T	25.3	Very low	24.9	Very low	108 Å²	108	140.9 Å²	140.9	66%	0.663	74%	0.741	S	S	*	*				48.8	132.8	83.2	79.9	0	0	0	0	113.7
1089	K	23.3	Very low	24.6	Very low	185 Å²	185	146.5 Å²	146.5	80%	0.804	76%	0.763	S	S	*	*			trans	95.6	95.8	172.9	-58.2	173.6	-178.9	172.7	0	113.9
1090	K	23.9	Very low	24.6	Very low	187 Å²	187	149.3 Å²	149.3	81%	0.813	76%	0.761	S	S	*	*				66	87.9	86.9	-80.8	-173.4	173.3	179.1	0	111.8
1091	V	27	Very low	24.3	Very low	136 Å²	136	142.8 Å²	142.8	82%	0.824	75%	0.751	S	S	*	*			trans	-152.6	87.8	142.1	-177.5	0	0	0	0	102.8
1092	N	25.2	Very low	24.1	Very low	134 Å²	134	142.4 Å²	142.4	72%	0.717	76%	0.755	S	S	*	*				46.3	121.6	56.4	-112.1	15	0	0	0	112.4
1093	K	24.9	Very low	24.3	Very low	198 Å²	198	135.8 Å²	135.8	86%	0.861	75%	0.745	S	S	*	*			trans	87.4	92.5	-172.8	-56	177.4	178	-176.7	0	110.9
1094	G	23.8	Very low	24.4	Very low	65 Å²	65	131.3 Å²	131.3	67%	0.67	74%	0.738	S	S	*	*			cis	75.3	114.4	36.3	0	0	0	0	0	108.5
1095	L	23.1	Very low	24.7	Very low	154 Å²	154	136.2 Å²	136.2	81%	0.806	75%	0.747	S	S	*	*				178	106.3	129.3	-121	55.8	0	0	0	103.5
1096	S	22.4	Very low	24.9	Very low	86 Å²	86	133.4 Å²	133.4	60%	0.601	75%	0.749	S	S	*	*				60.5	149.9	59.6	85.3	0	0	0	0	112.6
1097	L	22.5	Very low	25.4	Very low	142 Å²	142	134.3 Å²	134.3	74%	0.743	76%	0.756	S	S	*	*			trans	85.4	131.1	-179.5	-80.7	80.9	0	0	0	113.5
1098	S	23.4	Very low	25.6	Very low	86 Å²	86	136.9 Å²	136.9	60%	0.601	76%	0.76	S	S	*	*			cis	-174.4	124.3	8.2	29.1	0	0	0	0	105.1
1099	Q	23.6	Very low	26.1	Very low	168 Å²	168	136.9 Å²	136.9	79%	0.785	75%	0.753	S	S	*	*				62.5	107.8	93.5	-73.7	177	-54	0	0	112.9
1100	E	26.6	Very low	26.6	Very low	188 Å²	188	136.4 Å²	136.4	88%	0.879	75%	0.751	S	S	*	*				-160.9	102.4	119.3	-102.7	172.6	174.8	0	0	105.6
1101	S	23.8	Very low	27	Very low	92 Å²	92	131.2 Å²	131.2	64%	0.643	74%	0.743	S	S	*	*				54.2	103.9	62.7	79.9	0	0	0	0	111.9
1102	T	26	Very low	27.5	Very low	144 Å²	144	126.8 Å²	126.8	88%	0.883	72%	0.717	S	S	*	*				-174.1	143	94.2	41.6	0	0	0	0	105.5
1103	G	27.4	Very low	28.1	Very low	68 Å²	68	124.8 Å²	124.8	70%	0.701	71%	0.705	S	S	*	*			cis	148.6	146.3	29.4	0	0	0	0	0	104
1104	I	26.1	Very low	28.5	Very low	143 Å²	143	121.5 Å²	121.5	73%	0.733	69%	0.687	S	S	*	*			cis	-178.7	141.5	28.4	-95.2	155	0	0	0	105.1
1105	K	29.2	Very low	29.2	Very low	207 Å²	207	120.4 Å²	120.4	90%	0.9	67%	0.672	S	S	*	*			trans	68.8	119.2	162.7	-67.4	162.2	-168.7	-177.2	0	117.8
1106	G	28.2	Very low	29.8	Very low	70 Å²	70	118 Å²	118	72%	0.722	66%	0.658	S	S	*	*			cis	177.8	174	0.4	0	0	0	0	0	111.5
1107	P	35.1	Very low	30.7	Very low	120 Å²	120	116.7 Å²	116.7	78%	0.779	65%	0.652	S	S	*	*			trans	-91.5	177.9	-176.6	37.1	-36.6	0	0	0	114
1108	K	27.1	Very low	31.4	Very low	193 Å²	193	112.6 Å²	112.6	84%	0.839	64%	0.639	S	S	*	*			trans	92.6	100.3	178.9	-54	170.2	-174.5	-175.9	0	109.1
1109	E	34.8	Very low	32.2	Very low	108 Å²	108	113 Å²	113	51%	0.505	63%	0.633	S	S	.	*				-171.6	83.1	80.3	-79.6	-178	142.5	0	0	110.2	T1112 L1113	E1109-T1112 VanDerWaalsContact CB-CB 3.42Å; E1109-T1112 VanDerWaalsContact CB-OG1 3.23Å; E1109-T1112 WeakPolarHBondContact CB-OG1 3.48Å; E1109-T1112 WeakPolarHBondContact CG-OG1 3.27Å; E1109-T1112 WeakPolarHBondContact OE1-CB 3.45Å; E1109-T1112 PolarHBondContact OE1-OG1 2.84Å; E1109-T1112 WeakPolarHBondContact OE2-CB 3.39Å; E1109-T1112 WeakPolarHBondContact OE2-CG2 3.5Å; E1109-T1112 PolarHBondContact OE2-OG1 3.35Å; E1109-L1113 WeakPolarHBondContact O-CB 3.5Å; E1109-L1113 PolarHBondContact O-N 3.47Å
1110	F	35	Very low	33	Very low	176 Å²	176	107.5 Å²	107.5	77%	0.772	62%	0.617	S	S	*	*	H	α-helix	trans	-82.4	-4.2	166.9	-113.5	-94.5	0	0	0	112.4	L1113 R1114	F1110-L1113 HydrophobicContact CD2-CD1 4.36Å; F1110-L1113 HydrophobicContact CE1-CD1 4.5Å; F1110-L1113 HydrophobicContact CE2-CD1 4Å; F1110-L1113 HydrophobicContact CZ-CD1 4.08Å; F1110-R1114 VanDerWaalsContact O-CB 3.3Å; F1110-R1114 WeakPolarHBondContact O-CB 3.31Å; F1110-R1114 PolarHBondContact O-N 2.82Å
1111	A	32.5	Very low	33.6	Very low	77 Å²	77	101.5 Å²	101.5	64%	0.636	60%	0.599	S	S	*	*	H	α-helix	trans	-91.3	-27.7	165.6	0	0	0	0	0	112.5	A1115	A1111-A1115 WeakPolarHBondContact O-CA 3.31Å; A1111-A1115 WeakPolarHBondContact O-CB 3.23Å; A1111-A1115 PolarHBondContact O-N 3.33Å
1112	T	37.2	Very low	34.3	Very low	44 Å²	44	99.2 Å²	99.2	27%	0.27	59%	0.586	S	S	.	*	H	α-helix	trans	-98.4	-15.7	175.4	-28.4	0	0	0	0	112	E1109 A1115 M1116	E1109-T1112 VanDerWaalsContact CB-CB 3.42Å; E1109-T1112 VanDerWaalsContact CB-OG1 3.23Å; E1109-T1112 WeakPolarHBondContact CB-OG1 3.48Å; E1109-T1112 WeakPolarHBondContact CG-OG1 3.27Å; E1109-T1112 WeakPolarHBondContact OE1-CB 3.45Å; E1109-T1112 PolarHBondContact OE1-OG1 2.84Å; E1109-T1112 WeakPolarHBondContact OE2-CB 3.39Å; E1109-T1112 WeakPolarHBondContact OE2-CG2 3.5Å; E1109-T1112 PolarHBondContact OE2-OG1 3.35Å; T1112-A1115 CarbonylContact O-C 3.52Å; T1112-M1116 HydrophobicContact CG2-CE 4.02Å; T1112-M1116 HydrophobicContact CG2-CG 4.43Å; T1112-M1116 VanDerWaalsContact O-CA 3.31Å; T1112-M1116 WeakPolarHBondContact O-CA 3.12Å; T1112-M1116 WeakPolarHBondContact O-CB 2.96Å; T1112-M1116 WeakPolarHBondContact O-CE 3.4Å; T1112-M1116 WeakPolarHBondContact O-CG 3.43Å; T1112-M1116 PolarHBondContact O-N 2.54Å
1113	L	38.1	Very low	34.9	Very low	91 Å²	91	95.5 Å²	95.5	48%	0.476	56%	0.563	S	S	.	*	H	α-helix	trans	-71.2	-52.6	159.5	-172.5	167.4	0	0	0	108.3	E1109 F1110 A1115 M1116 A1117	E1109-L1113 WeakPolarHBondContact O-CB 3.5Å; E1109-L1113 PolarHBondContact O-N 3.47Å; F1110-L1113 HydrophobicContact CD2-CD1 4.36Å; F1110-L1113 HydrophobicContact CE1-CD1 4.5Å; F1110-L1113 HydrophobicContact CE2-CD1 4Å; F1110-L1113 HydrophobicContact CZ-CD1 4.08Å; L1113-A1115 PolarHBondContact O-N 2.95Å; L1113-M1116 CarbonylContact O-C 3.24Å; L1113-M1116 PolarHBondContact O-N 2.75Å; L1113-A1117 PolarHBondContact O-N 2.72Å
1114	R	33.7	Very low	35.3	Very low	130 Å²	130	95.5 Å²	95.5	49%	0.491	56%	0.557	S	S	.	*	H	α-helix	trans	-66	-25.7	174.1	-149.4	178	-161.3	-174.6	8.1	112.3	E680 F1110 A1118	E680-R1114 IonicContact OE1-CZ 3.07Å; E680-R1114 IonicContact OE1-NE 2.72Å; E680-R1114 PolarHBondContact OE1-NE 3.12Å; E680-R1114 IonicContact OE1-NH2 2.8Å; E680-R1114 PolarHBondContact OE1-NH2 2.73Å; F1110-R1114 VanDerWaalsContact O-CB 3.3Å; F1110-R1114 WeakPolarHBondContact O-CB 3.31Å; F1110-R1114 PolarHBondContact O-N 2.82Å; R1114-A1118 WeakPolarHBondContact O-CB 3.17Å; R1114-A1118 PolarHBondContact O-N 2.84Å
1115	A	37.9	Very low	35.6	Very low	41 Å²	41	91.8 Å²	91.8	34%	0.339	55%	0.547	S	S	.	.	H	α-helix	trans	-106.6	38.4	164.7	0	0	0	0	0	114	A1111 T1112 L1113 A1118 L1119	A1111-A1115 WeakPolarHBondContact O-CA 3.31Å; A1111-A1115 WeakPolarHBondContact O-CB 3.23Å; A1111-A1115 PolarHBondContact O-N 3.33Å; T1112-A1115 CarbonylContact O-C 3.52Å; L1113-A1115 PolarHBondContact O-N 2.95Å; A1115-A1118 HydrophobicContact CB-CB 4.36Å; A1115-L1119 WeakPolarHBondContact O-CB 3.09Å
1116	M	36	Very low	36	Very low	104 Å²	104	86.2 Å²	86.2	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-124.8	-17.1	149.8	-86.8	-177.4	-81.8	0	0	108.1	T1112 L1113 A1120	T1112-M1116 HydrophobicContact CG2-CE 4.02Å; T1112-M1116 HydrophobicContact CG2-CG 4.43Å; T1112-M1116 VanDerWaalsContact O-CA 3.31Å; T1112-M1116 WeakPolarHBondContact O-CA 3.12Å; T1112-M1116 WeakPolarHBondContact O-CB 2.96Å; T1112-M1116 WeakPolarHBondContact O-CE 3.4Å; T1112-M1116 WeakPolarHBondContact O-CG 3.43Å; T1112-M1116 PolarHBondContact O-N 2.54Å; L1113-M1116 CarbonylContact O-C 3.24Å; L1113-M1116 PolarHBondContact O-N 2.75Å; M1116-A1120 WeakPolarHBondContact O-CA 3.5Å; M1116-A1120 WeakPolarHBondContact O-CB 3.19Å; M1116-A1120 PolarHBondContact O-N 3.22Å
1117	A	39.9	Very low	36.1	Very low	58 Å²	58	87.2 Å²	87.2	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-76.1	-43.3	155.2	0	0	0	0	0	110.9	L1113 A1121	L1113-A1117 PolarHBondContact O-N 2.72Å; A1117-A1121 WeakPolarHBondContact O-CA 3.24Å; A1117-A1121 WeakPolarHBondContact O-CB 3.4Å; A1117-A1121 PolarHBondContact O-N 3.18Å
1118	A	38.4	Very low	35.9	Very low	56 Å²	56	85.6 Å²	85.6	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-81.2	-21.9	173.2	0	0	0	0	0	113.3	R1114 A1115 A1122	R1114-A1118 WeakPolarHBondContact O-CB 3.17Å; R1114-A1118 PolarHBondContact O-N 2.84Å; A1115-A1118 HydrophobicContact CB-CB 4.36Å; A1118-A1122 WeakPolarHBondContact O-CB 3.42Å; A1118-A1122 PolarHBondContact O-N 3.21Å
1119	L	40.1	Very low	35.9	Very low	94 Å²	94	80 Å²	80	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-89.3	-30	169.3	-170.8	62.4	0	0	0	112.8	A1115 A1121 A1122 T1123	A1115-L1119 WeakPolarHBondContact O-CB 3.09Å; L1119-A1121 VanDerWaalsContact C-N 3.33Å; L1119-A1122 HydrophobicContact CD1-CB 4.47Å; L1119-A1122 PolarHBondContact O-N 3.24Å; L1119-T1123 HydrophobicContact CD1-CG2 3.97Å; L1119-T1123 HydrophobicContact CG-CG2 4.2Å; L1119-T1123 VanDerWaalsContact O-CB 3.28Å; L1119-T1123 WeakPolarHBondContact O-CB 3.46Å; L1119-T1123 WeakPolarHBondContact O-CG2 3.47Å; L1119-T1123 PolarHBondContact O-N 3.1Å; L1119-T1123 PolarHBondContact O-OG1 3.35Å
1120	A	40.7	Very low	35.6	Very low	53 Å²	53	81.5 Å²	81.5	44%	0.438	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-33.5	162.1	0	0	0	0	0	110.6	M1116 A1124	M1116-A1120 WeakPolarHBondContact O-CA 3.5Å; M1116-A1120 WeakPolarHBondContact O-CB 3.19Å; M1116-A1120 PolarHBondContact O-N 3.22Å; A1120-A1124 WeakPolarHBondContact O-CA 3.24Å; A1120-A1124 WeakPolarHBondContact O-CB 3.06Å; A1120-A1124 PolarHBondContact O-N 2.84Å
1121	A	38.9	Very low	35.2	Very low	62 Å²	62	78 Å²	78	51%	0.512	52%	0.516	S	S	.	.	H	α-helix	trans	-72	-30.4	172.5	0	0	0	0	0	112.9	A1117 L1119 A1125	A1117-A1121 WeakPolarHBondContact O-CA 3.24Å; A1117-A1121 WeakPolarHBondContact O-CB 3.4Å; A1117-A1121 PolarHBondContact O-N 3.18Å; L1119-A1121 VanDerWaalsContact C-N 3.33Å; A1121-A1125 WeakPolarHBondContact O-CB 3.33Å; A1121-A1125 PolarHBondContact O-N 3.4Å
1122	A	38.9	Very low	34.9	Very low	44 Å²	44	78.5 Å²	78.5	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-80.9	-38.4	173.1	0	0	0	0	0	113.2	A1118 L1119 A1125 T1126	A1118-A1122 WeakPolarHBondContact O-CB 3.42Å; A1118-A1122 PolarHBondContact O-N 3.21Å; L1119-A1122 HydrophobicContact CD1-CB 4.47Å; L1119-A1122 PolarHBondContact O-N 3.24Å; A1122-A1125 CarbonylContact O-C 3.25Å; A1122-A1125 VanDerWaalsContact O-C 3.3Å; A1122-A1125 WeakPolarHBondContact O-CA 3.45Å; A1122-A1125 PolarHBondContact O-N 3.42Å; A1122-T1126 WeakPolarHBondContact O-CB 3.27Å; A1122-T1126 PolarHBondContact O-N 3.39Å; A1122-T1126 PolarHBondContact O-OG1 3.34Å
1123	T	37.1	Very low	34.3	Very low	66 Å²	66	85.1 Å²	85.1	41%	0.405	54%	0.536	S	S	.	.	H	α-helix	trans	-75.2	-31.9	173.3	56.6	0	0	0	0	111.7	L1119 A1125 T1126 A1127	L1119-T1123 HydrophobicContact CD1-CG2 3.97Å; L1119-T1123 HydrophobicContact CG-CG2 4.2Å; L1119-T1123 VanDerWaalsContact O-CB 3.28Å; L1119-T1123 WeakPolarHBondContact O-CB 3.46Å; L1119-T1123 WeakPolarHBondContact O-CG2 3.47Å; L1119-T1123 PolarHBondContact O-N 3.1Å; L1119-T1123 PolarHBondContact O-OG1 3.35Å; T1123-A1125 PolarHBondContact O-N 2.97Å; T1123-T1126 WeakPolarHBondContact CA-OG1 3.49Å; T1123-T1126 PolarHBondContact O-N 3.49Å; T1123-A1127 WeakPolarHBondContact O-CA 3.28Å; T1123-A1127 WeakPolarHBondContact O-CB 3.17Å; T1123-A1127 PolarHBondContact O-N 2.83Å
1124	A	36.1	Very low	33.9	Very low	68 Å²	68	83.9 Å²	83.9	56%	0.562	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.8	163.7	0	0	0	0	0	112.7	A1120 V1128	A1120-A1124 WeakPolarHBondContact O-CA 3.24Å; A1120-A1124 WeakPolarHBondContact O-CB 3.06Å; A1120-A1124 PolarHBondContact O-N 2.84Å; A1124-V1128 VanDerWaalsContact O-CG2 3.26Å; A1124-V1128 WeakPolarHBondContact O-CG2 3.49Å
1125	A	33.3	Very low	33.6	Very low	65 Å²	65	81.7 Å²	81.7	54%	0.537	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	3.1	173.2	0	0	0	0	0	114.6	A1121 A1122 T1123	A1121-A1125 WeakPolarHBondContact O-CB 3.33Å; A1121-A1125 PolarHBondContact O-N 3.4Å; A1122-A1125 CarbonylContact O-C 3.25Å; A1122-A1125 VanDerWaalsContact O-C 3.3Å; A1122-A1125 WeakPolarHBondContact O-CA 3.45Å; A1122-A1125 PolarHBondContact O-N 3.42Å; T1123-A1125 PolarHBondContact O-N 2.97Å
1126	T	37.8	Very low	33	Very low	91 Å²	91	83.9 Å²	83.9	56%	0.558	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.9	-13.9	-179.7	50.4	0	0	0	0	114.1	A1122 T1123 V1128 A1129	A1122-T1126 WeakPolarHBondContact O-CB 3.27Å; A1122-T1126 PolarHBondContact O-N 3.39Å; A1122-T1126 PolarHBondContact O-OG1 3.34Å; T1123-T1126 WeakPolarHBondContact CA-OG1 3.49Å; T1123-T1126 PolarHBondContact O-N 3.49Å; T1126-V1128 PolarHBondContact O-N 3.39Å; T1126-A1129 WeakPolarHBondContact O-CB 3.22Å; T1126-A1129 PolarHBondContact O-N 2.76Å
1127	A	30.1	Very low	32.7	Very low	90 Å²	90	82 Å²	82	74%	0.744	55%	0.545	S	S	*	.	S	Bend	trans	-73.5	3	145.7	0	0	0	0	0	111.5	T1123	T1123-A1127 WeakPolarHBondContact O-CA 3.28Å; T1123-A1127 WeakPolarHBondContact O-CB 3.17Å; T1123-A1127 PolarHBondContact O-N 2.83Å
1128	V	29.9	Very low	32.1	Very low	87 Å²	87	85.2 Å²	85.2	53%	0.527	55%	0.554	S	S	.	*	S	Bend	trans	-100.6	64.6	155.2	-177.4	0	0	0	0	107.1	L388 A1124 T1126	L388-V1128 HydrophobicContact CD2-CG2 4.14Å; A1124-V1128 VanDerWaalsContact O-CG2 3.26Å; A1124-V1128 WeakPolarHBondContact O-CG2 3.49Å; T1126-V1128 PolarHBondContact O-N 3.39Å
1129	A	27.6	Very low	31.6	Very low	74 Å²	74	88.6 Å²	88.6	61%	0.612	56%	0.563	S	S	*	*			trans	-161.9	54.9	170.7	0	0	0	0	0	110.5	T1126	T1126-A1129 WeakPolarHBondContact O-CB 3.22Å; T1126-A1129 PolarHBondContact O-N 2.76Å
1130	D	27.8	Very low	31	Very low	141 Å²	141	91.5 Å²	91.5	75%	0.754	58%	0.577	S	S	*	*			trans	-142.1	99.6	138	-160.7	-11.5	0	0	0	108.3
1131	P	26.9	Very low	30.4	Very low	103 Å²	103	95.9 Å²	95.9	67%	0.669	59%	0.592	S	S	*	*			trans	-100	88.6	-167.7	35.9	-29.3	0	0	0	110.9
1132	T	25.8	Very low	29.7	Very low	86 Å²	86	97.8 Å²	97.8	53%	0.528	60%	0.599	S	S	.	*			trans	-152.8	81.8	171.7	53.4	0	0	0	0	115.2	K381	K381-T1132 HydrophobicContact CB-CG2 3.59Å; K381-T1132 HydrophobicContact CG-CG2 3.78Å
1133	K	26	Very low	29.1	Very low	183 Å²	183	101.7 Å²	101.7	80%	0.796	62%	0.624	S	S	*	*	S	Bend	trans	178.9	89.8	139.3	-98.4	171.6	-175.9	-173.5	0	109.9
1134	T	28.2	Very low	28.5	Very low	66 Å²	66	105.2 Å²	105.2	41%	0.405	64%	0.64	S	S	.	*				78.3	121.9	108.2	51	0	0	0	0	115.4	D380 L382 T384	D380-T1134 WeakPolarHBondContact O-CG2 3.37Å; L382-T1134 HydrophobicContact CB-CG2 4.1Å; L382-T1134 WeakPolarHBondContact O-CA 3.22Å; T384-T1134 VanDerWaalsContact CG2-N 3.26Å
1135	T	27.7	Very low	28	Very low	83 Å²	83	110 Å²	110	51%	0.509	65%	0.648	S	S	.	*			cis	-143.7	175.4	5	65.7	0	0	0	0	113.6	L382 T384	L382-T1135 HydrophobicContact CB-CG2 4.29Å; L382-T1135 HydrophobicContact CD2-CG2 3.9Å; L382-T1135 HydrophobicContact CG-CG2 4.48Å; L382-T1135 WeakPolarHBondContact O-CA 3.37Å; T384-T1135 WeakPolarHBondContact CA-O 3.37Å; T384-T1135 VanDerWaalsContact CG2-N 3.31Å
1136	Q	26.9	Very low	27.7	Very low	88 Å²	88	115.4 Å²	115.4	41%	0.411	66%	0.66	S	S	.	*			trans	-67.7	169.4	162.5	-166.1	158.5	4.7	0	0	111.5	T383 D1138	T383-Q1136 VanDerWaalsContact CB-OE1 3.24Å; T383-Q1136 WeakPolarHBondContact O-CA 2.95Å; T383-Q1136 VanDerWaalsContact O-CB 3.25Å; T383-Q1136 WeakPolarHBondContact O-CB 3.27Å; T383-Q1136 PolarHBondContact O-N 3Å; T383-Q1136 WeakPolarHBondContact OG1-CB 3.43Å; T383-Q1136 PolarHBondContact OG1-OE1 3.45Å; Q1136-D1138 PolarHBondContact NE2-OD1 2.89Å
1137	G	28.4	Very low	27.4	Very low	65 Å²	65	119.7 Å²	119.7	67%	0.67	67%	0.674	S	S	*	*			cis	171.4	174.7	-1.7	0	0	0	0	0	109.2
1138	D	28.1	Very low	27.6	Very low	125 Å²	125	118.5 Å²	118.5	67%	0.668	66%	0.659	S	S	*	*			cis	-151.4	178.5	15.8	-138.8	95.1	0	0	0	110.6	Q1136	Q1136-D1138 PolarHBondContact NE2-OD1 2.89Å
1139	L	28	Very low	27.9	Very low	127 Å²	127	117.3 Å²	117.3	67%	0.665	65%	0.649	S	S	*	*			trans	-114.4	141.2	-153.3	-176.7	62.7	0	0	0	117.6
1140	I	27.4	Very low	28.9	Very low	154 Å²	154	118 Å²	118	79%	0.79	64%	0.64	S	S	*	*			trans	-116.5	100.3	159	-58.3	178.7	0	0	0	111
1141	I	27.7	Very low	29.9	Very low	145 Å²	145	118.7 Å²	118.7	74%	0.744	64%	0.638	S	S	*	*			trans	36.1	133.1	136.7	-53	179.1	0	0	0	119.7
1142	P	24.7	Very low	30.8	Very low	102 Å²	102	117 Å²	117	66%	0.662	62%	0.622	S	S	*	*			trans	-104	135	-154.9	35.6	-21.7	0	0	0	114
1143	S	25.3	Very low	32.2	Very low	127 Å²	127	113.8 Å²	113.8	89%	0.888	60%	0.602	S	S	*	*			trans	-102.9	40.9	166.9	59.1	0	0	0	0	112.2
1144	N	24.7	Very low	33.8	Very low	139 Å²	139	109.6 Å²	109.6	74%	0.743	58%	0.584	S	S	*	*			trans	-79.6	122.3	172.6	-79.1	-21.5	0	0	0	110.5
1145	F	25.4	Very low	35.3	Very low	168 Å²	168	110.5 Å²	110.5	74%	0.737	59%	0.593	S	S	*	*	S	Bend	trans	-157.8	-27.7	174.3	-146.6	-88.8	0	0	0	115.3
1146	F	28	Very low	37.2	Very low	179 Å²	179	108.4 Å²	108.4	79%	0.785	58%	0.578	S	S	*	*	S	Bend	trans	-140	-6	-162.3	-98.6	-60.8	0	0	0	118.1	P1148	F1146-P1148 VanDerWaalsContact O-CD 3.28Å; F1146-P1148 WeakPolarHBondContact O-CD 3.27Å
1147	E	30.8	Very low	39.4	Very low	182 Å²	182	109 Å²	109	85%	0.85	58%	0.581	S	S	*	*			trans	-75.6	114.6	178.5	-76.5	-171.9	155.3	0	0	110.4
1148	P	33.5	Very low	41.8	Very low	64 Å²	64	106.5 Å²	106.5	42%	0.416	55%	0.552	S	S	.	*			trans	-67	137	177.5	27.5	-30.4	0	0	0	109.6	F1146 E1150 T1153	F1146-P1148 VanDerWaalsContact O-CD 3.28Å; F1146-P1148 WeakPolarHBondContact O-CD 3.27Å; P1148-E1150 PolarHBondContact O-N 3.31Å; P1148-T1153 HydrophobicContact CG-CG2 4.46Å
1149	D	36.4	Very low	44.2	Very low	63 Å²	63	104.5 Å²	104.5	34%	0.337	54%	0.541	S	S	.	.			trans	-49.3	105.7	-175.5	-30.5	26.4	0	0	0	108.5	K677 E1151 Q1152	K677-D1149 IonicContact NZ-OD2 3.68Å; K677-D1149 PolarHBondContact NZ-OD2 2.83Å; D1149-E1151 PolarHBondContact O-N 3.48Å; D1149-E1151 VanDerWaalsContact O-N 3.08Å; D1149-Q1152 HydrophobicContact CB-CG 4.11Å; D1149-Q1152 WeakPolarHBondContact O-CA 3.28Å; D1149-Q1152 VanDerWaalsContact O-CB 3.24Å; D1149-Q1152 WeakPolarHBondContact O-CB 3.35Å; D1149-Q1152 PolarHBondContact O-N 3.35Å; D1149-Q1152 PolarHBondContact OD2-NE2 2.95Å
1150	E	49.6	Very low	46.9	Very low	89 Å²	89	99.5 Å²	99.5	42%	0.416	51%	0.513	S	S	.	.	H	α-helix	trans	-59.7	-33.6	-160.7	-163.6	-150.1	-128.6	0	0	113.3	Y608 P1148 Q1152 T1153 K1154	Y608-E1150 HydrophobicContact CE2-CG 4.46Å; Y608-E1150 WeakPolarHBondContact CE2-OE1 3.28Å; P1148-E1150 PolarHBondContact O-N 3.31Å; E1150-Q1152 PolarHBondContact O-N 2.94Å; E1150-T1153 PolarHBondContact O-N 2.92Å; E1150-T1153 VanDerWaalsContact O-N 3.12Å; E1150-T1153 PolarHBondContact O-OG1 3.09Å; E1150-K1154 PolarHBondContact O-N 3.42Å; E1150-K1154 WeakPolarHBondContact OE2-CE 3.2Å; E1150-K1154 IonicContact OE2-NZ 2.79Å; E1150-K1154 PolarHBondContact OE2-NZ 3Å
1151	E	48.7	Very low	49.8	Very low	154 Å²	154	92.6 Å²	92.6	72%	0.72	48%	0.479	S	S	*	.	H	α-helix	trans	-53.6	-23.9	172	-73.5	-178.3	147.4	0	0	113.5	D1149	D1149-E1151 PolarHBondContact O-N 3.48Å; D1149-E1151 VanDerWaalsContact O-N 3.08Å
1152	Q	45.3	Very low	52.8	Low	69 Å²	69	86.2 Å²	86.2	32%	0.322	45%	0.448	S	S	.	.	H	α-helix	trans	-80.8	-37.7	178.3	-64.8	175.6	22.4	0	0	112.7	D1149 E1150 K1154 S1155	D1149-Q1152 HydrophobicContact CB-CG 4.11Å; D1149-Q1152 WeakPolarHBondContact O-CA 3.28Å; D1149-Q1152 VanDerWaalsContact O-CB 3.24Å; D1149-Q1152 WeakPolarHBondContact O-CB 3.35Å; D1149-Q1152 PolarHBondContact O-N 3.35Å; D1149-Q1152 PolarHBondContact OD2-NE2 2.95Å; E1150-Q1152 PolarHBondContact O-N 2.94Å; Q1152-K1154 PolarHBondContact O-N 3Å; Q1152-S1155 PolarHBondContact O-N 3.14Å; Q1152-S1155 PolarHBondContact O-OG 2.73Å
1153	T	55.5	Low	56	Low	17 Å²	17	81.6 Å²	81.6	10%	0.104	42%	0.417	C	S	.	.	H	α-helix	trans	-67.6	-25.3	176.8	59.4	0	0	0	0	112.1	P1148 E1150 S1155	P1148-T1153 HydrophobicContact CG-CG2 4.46Å; E1150-T1153 PolarHBondContact O-N 2.92Å; E1150-T1153 VanDerWaalsContact O-N 3.12Å; E1150-T1153 PolarHBondContact O-OG1 3.09Å; T1153-S1155 PolarHBondContact O-N 3.19Å
1154	K	59.8	Low	59.2	Low	96 Å²	96	75.7 Å²	75.7	42%	0.417	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.3	170.8	-67.4	179	-176.6	163.6	0	114	T606 Y608 E1150 Q1152	T606-K1154 WeakPolarHBondContact CG2-O 3.36Å; Y608-K1154 HydrophobicContact CD1-CG 4.13Å; Y608-K1154 HydrophobicContact CD2-CG 4.43Å; Y608-K1154 HydrophobicContact CG-CG 4.02Å; E1150-K1154 PolarHBondContact O-N 3.42Å; E1150-K1154 WeakPolarHBondContact OE2-CE 3.2Å; E1150-K1154 IonicContact OE2-NZ 2.79Å; E1150-K1154 PolarHBondContact OE2-NZ 3Å; Q1152-K1154 PolarHBondContact O-N 3Å
1155	S	60	Low	62.5	Low	84 Å²	84	69 Å²	69	59%	0.587	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-13.4	-177.7	71.9	0	0	0	0	114.6	Q1152 T1153 Q1157	Q1152-S1155 PolarHBondContact O-N 3.14Å; Q1152-S1155 PolarHBondContact O-OG 2.73Å; T1153-S1155 PolarHBondContact O-N 3.19Å; S1155-Q1157 PolarHBondContact O-N 2.96Å
1156	I	67.2	Low	65.7	Low	40 Å²	40	61.3 Å²	61.3	21%	0.205	31%	0.306	C	S	.	.			trans	-82.5	106.4	-175.1	-55.5	167.4	0	0	0	109.4	T606 I607	T606-I1156 WeakPolarHBondContact CA-O 3.35Å; I607-I1156 HydrophobicContact CD1-CB 3.83Å; I607-I1156 HydrophobicContact CD1-CD1 4.32Å; I607-I1156 HydrophobicContact CD1-CG2 3.39Å; I607-I1156 HydrophobicContact CG1-CB 4.21Å; I607-I1156 HydrophobicContact CG1-CG2 4.05Å; I607-I1156 PolarHBondContact N-O 2.93Å; I607-I1156 VanDerWaalsContact N-O 3.13Å
1157	Q	72.3	Confident	68.8	Low	101 Å²	101	53 Å²	53	47%	0.472	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-76.9	144.3	175	-66.3	-179.2	-29.5	0	0	111.5	D603 S1155	D603-Q1157 PolarHBondContact OD1-NE2 2.9Å; S1155-Q1157 PolarHBondContact O-N 2.96Å
1158	L	78.5	Confident	71.8	Confident	12 Å²	12	44.3 Å²	44.3	6%	0.063	23%	0.229	C	C	.	.			trans	-87.1	134.8	175.2	-71.6	158	0	0	0	110	L605 I607 L610 F669 R1160 E1164	L605-L1158 HydrophobicContact CD2-CD1 3.8Å; L605-L1158 HydrophobicContact CG-CD1 3.88Å; I607-L1158 HydrophobicContact CG1-CD2 4.1Å; I607-L1158 HydrophobicContact CG1-CG 4.31Å; L610-L1158 HydrophobicContact CB-CD1 4.33Å; L610-L1158 HydrophobicContact CD2-CD1 3.91Å; F669-L1158 HydrophobicContact CE2-CD2 3.97Å; F669-L1158 HydrophobicContact CZ-CD2 4.43Å; L1158-R1160 PolarHBondContact O-N 3.44Å; L1158-E1164 HydrophobicContact CD1-CG 4.15Å; L1158-E1164 HydrophobicContact CD2-CG 4.4Å
1159	D	78.6	Confident	74.6	Confident	82 Å²	82	41.2 Å²	41.2	44%	0.439	21%	0.209	S	C	.	.	S	Bend	trans	-65.9	-25.3	-174.6	-54.7	-43.3	0	0	0	113.5	K672 Y1251	K672-D1159 IonicContact NZ-OD1 3.81Å; K672-D1159 PolarHBondContact NZ-OD1 3.31Å; K672-D1159 IonicContact NZ-OD2 2.76Å; K672-D1159 PolarHBondContact NZ-OD2 3.13Å; D1159-Y1251 HydrophobicContact CB-CE1 3.92Å; D1159-Y1251 WeakPolarHBondContact CB-OH 3.42Å
1160	R	84.8	Confident	77.2	Confident	22 Å²	22	38.3 Å²	38.3	8%	0.083	19%	0.194	C	C	.	.			trans	-139.1	79.7	-179.9	-70.1	-161.7	179.1	-164.9	13.3	111.4	L1158 A1162 R1163 E1185 E1187 Y1251	L1158-R1160 PolarHBondContact O-N 3.44Å; R1160-A1162 PolarHBondContact O-N 3.14Å; R1160-R1163 HydrophobicContact CB-CB 4.16Å; R1160-R1163 PolarHBondContact O-N 2.95Å; R1160-E1185 IonicContact CZ-OE1 3.26Å; R1160-E1185 IonicContact NH1-OE1 3.06Å; R1160-E1185 PolarHBondContact NH1-OE1 3.01Å; R1160-E1187 IonicContact CZ-OE1 3.3Å; R1160-E1187 IonicContact CZ-OE2 2.79Å; R1160-E1187 VanDerWaalsContact CZ-OE2 3.29Å; R1160-E1187 VanDerWaalsContact NH1-CG 3.31Å; R1160-E1187 IonicContact NH1-OE1 3.57Å; R1160-E1187 IonicContact NH1-OE2 2.74Å; R1160-E1187 PolarHBondContact NH1-OE2 3.5Å; R1160-E1187 IonicContact NH2-OE1 3.62Å; R1160-E1187 PolarHBondContact NH2-OE1 3.04Å; R1160-E1187 IonicContact NH2-OE2 2.98Å; R1160-E1187 PolarHBondContact NH2-OE2 3.27Å; R1160-E1187 VanDerWaalsContact NH2-OE2 3.15Å; R1160-Y1251 HydrophobicContact CG-CD1 4.3Å; R1160-Y1251 HydrophobicContact CG-CD2 4.43Å; R1160-Y1251 HydrophobicContact CG-CE1 4.11Å; R1160-Y1251 HydrophobicContact CG-CE2 4.25Å; R1160-Y1251 HydrophobicContact CG-CG 4.45Å; R1160-Y1251 VanDerWaalsContact NE-CE2 3.28Å
1161	P	89.7	Confident	79.2	Confident	10 Å²	10	34.3 Å²	34.3	7%	0.065	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-37.3	-173.4	26.5	-36.4	0	0	0	113.8	L601 E602 L605 R1163 E1164 L1165	L601-P1161 HydrophobicContact CB-CB 4.21Å; L601-P1161 HydrophobicContact CB-CG 4Å; E602-P1161 HydrophobicContact CG-CG 3.87Å; L605-P1161 HydrophobicContact CB-CB 3.85Å; L605-P1161 HydrophobicContact CD2-CB 3.62Å; L605-P1161 WeakPolarHBondContact CD2-O 3.12Å; L605-P1161 HydrophobicContact CG-CB 4.39Å; P1161-R1163 VanDerWaalsContact C-N 3.31Å; P1161-R1163 PolarHBondContact O-N 2.8Å; P1161-E1164 PolarHBondContact O-N 2.75Å; P1161-E1164 VanDerWaalsContact O-N 3.14Å; P1161-L1165 PolarHBondContact O-N 2.9Å
1162	A	90	Very high	81.1	Confident	11 Å²	11	27.2 Å²	27.2	9%	0.091	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-39	177.8	0	0	0	0	0	112.8	R1160 E1164 L1165 L1166 M1184	R1160-A1162 PolarHBondContact O-N 3.14Å; A1162-E1164 PolarHBondContact O-N 2.82Å; A1162-L1165 PolarHBondContact O-N 2.84Å; A1162-L1166 VanDerWaalsContact O-CB 3.29Å; A1162-L1166 WeakPolarHBondContact O-CB 3.39Å; A1162-L1166 PolarHBondContact O-N 2.8Å; A1162-M1184 HydrophobicContact CB-CB 4.1Å
1163	R	92.3	Very high	83	Confident	5 Å²	5	24.3 Å²	24.3	2%	0.019	13%	0.131	C	C	.	.	H	α-helix	trans	-63.1	-41.9	175.8	-172.6	-174.7	112.5	-95.6	-14.9	111.7	L663 R1160 P1161 L1166 I1167 E1185 Y1251 Y1252	L663-R1163 VanDerWaalsContact CD2-NH2 3.33Å; R1160-R1163 HydrophobicContact CB-CB 4.16Å; R1160-R1163 PolarHBondContact O-N 2.95Å; P1161-R1163 VanDerWaalsContact C-N 3.31Å; P1161-R1163 PolarHBondContact O-N 2.8Å; R1163-L1166 WeakPolarHBondContact O-CB 3.07Å; R1163-L1166 PolarHBondContact O-N 3.15Å; R1163-I1167 HydrophobicContact CG-CD1 4.27Å; R1163-I1167 WeakPolarHBondContact O-CG1 3.41Å; R1163-I1167 PolarHBondContact O-N 2.91Å; R1163-E1185 HydrophobicContact CB-CG 4.34Å; R1163-Y1251 PolarHBondContact NE-O 3.04Å; R1163-Y1252 HydrophobicContact CG-CE1 4.46Å
1164	E	91.9	Very high	84.6	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-70.8	-39.3	-178.2	-51.2	-60.8	170.2	0	0	111.2	L605 L610 Y664 L1158 P1161 A1162 I1167 W1168	L605-E1164 HydrophobicContact CD2-CB 3.93Å; L610-E1164 HydrophobicContact CD2-CB 4.04Å; Y664-E1164 VanDerWaalsContact CE1-OE2 3.23Å; Y664-E1164 WeakPolarHBondContact CE1-OE2 3.29Å; Y664-E1164 PolarHBondContact OH-OE2 3.06Å; L1158-E1164 HydrophobicContact CD1-CG 4.15Å; L1158-E1164 HydrophobicContact CD2-CG 4.4Å; P1161-E1164 PolarHBondContact O-N 2.75Å; P1161-E1164 VanDerWaalsContact O-N 3.14Å; A1162-E1164 PolarHBondContact O-N 2.82Å; E1164-I1167 PolarHBondContact O-N 2.94Å; E1164-W1168 WeakPolarHBondContact O-CB 3.48Å; E1164-W1168 PolarHBondContact O-N 3.01Å
1165	L	93.1	Very high	86.1	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.3	-34.9	173.2	-72.6	171.6	0	0	0	112.7	L583 L601 L605 L613 P1161 A1162 W1168 S1169 F1181	L583-L1165 HydrophobicContact CD1-CD2 4.34Å; L601-L1165 HydrophobicContact CD1-CD1 4.48Å; L601-L1165 HydrophobicContact CD2-CD1 3.94Å; L605-L1165 HydrophobicContact CD1-CD1 4.45Å; L605-L1165 HydrophobicContact CD1-CD2 3.84Å; L605-L1165 HydrophobicContact CD1-CG 4.12Å; L605-L1165 HydrophobicContact CD2-CD1 4.35Å; L605-L1165 HydrophobicContact CD2-CD2 4.48Å; L605-L1165 HydrophobicContact CD2-CG 3.91Å; L613-L1165 HydrophobicContact CD1-CD2 4.15Å; P1161-L1165 PolarHBondContact O-N 2.9Å; A1162-L1165 PolarHBondContact O-N 2.84Å; L1165-W1168 HydrophobicContact CD2-CE3 4.22Å; L1165-S1169 WeakPolarHBondContact O-CB 3.46Å; L1165-S1169 PolarHBondContact O-N 3Å; L1165-S1169 PolarHBondContact O-OG 3.19Å; L1165-F1181 HydrophobicContact CB-CD1 3.77Å; L1165-F1181 HydrophobicContact CB-CD2 3.78Å; L1165-F1181 HydrophobicContact CB-CE1 3.87Å; L1165-F1181 HydrophobicContact CB-CE2 3.84Å; L1165-F1181 HydrophobicContact CB-CG 3.77Å; L1165-F1181 HydrophobicContact CB-CZ 3.91Å; L1165-F1181 HydrophobicContact CD1-CD1 4.06Å; L1165-F1181 HydrophobicContact CD1-CE1 3.49Å; L1165-F1181 VanDerWaalsContact CD1-CE1 3.49Å; L1165-F1181 HydrophobicContact CD1-CZ 3.79Å; L1165-F1181 HydrophobicContact CG-CE1 4.27Å; L1165-F1181 HydrophobicContact CG-CZ 4.29Å
1166	L	93.9	Very high	87.5	Confident	5 Å²	5	22.1 Å²	22.1	3%	0.026	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-50.9	171.6	175.1	68.7	0	0	0	111.1	A1162 R1163 S1169 I1170 A1178 F1181 W1182 A1191	A1162-L1166 VanDerWaalsContact O-CB 3.29Å; A1162-L1166 WeakPolarHBondContact O-CB 3.39Å; A1162-L1166 PolarHBondContact O-N 2.8Å; R1163-L1166 WeakPolarHBondContact O-CB 3.07Å; R1163-L1166 PolarHBondContact O-N 3.15Å; L1166-S1169 PolarHBondContact O-N 3.35Å; L1166-I1170 HydrophobicContact CD1-CD1 4.11Å; L1166-I1170 HydrophobicContact CG-CD1 4.15Å; L1166-I1170 WeakPolarHBondContact O-CG1 3.5Å; L1166-I1170 PolarHBondContact O-N 3.49Å; L1166-I1170 VanDerWaalsContact O-N 3.1Å; L1166-A1178 HydrophobicContact CD1-CB 3.95Å; L1166-A1178 WeakPolarHBondContact CD1-O 3.45Å; L1166-F1181 HydrophobicContact CB-CB 4.01Å; L1166-W1182 HydrophobicContact CD1-CB 4.23Å; L1166-A1191 HydrophobicContact CD2-CB 3.93Å
1167	I	92.8	Very high	88.6	Confident	4 Å²	4	20.2 Å²	20.2	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-63.7	-43.6	179.1	-66.7	168.6	0	0	0	110.9	I652 R1163 E1164 S1169 I1170 L1171 L1194	I652-I1167 HydrophobicContact CD1-CG2 3.81Å; I652-I1167 HydrophobicContact CG1-CG2 4.47Å; R1163-I1167 HydrophobicContact CG-CD1 4.27Å; R1163-I1167 WeakPolarHBondContact O-CG1 3.41Å; R1163-I1167 PolarHBondContact O-N 2.91Å; E1164-I1167 PolarHBondContact O-N 2.94Å; I1167-S1169 PolarHBondContact O-N 2.94Å; I1167-I1170 PolarHBondContact O-N 3.1Å; I1167-L1171 HydrophobicContact CG2-CD1 3.9Å; I1167-L1171 HydrophobicContact CG2-CG 4.32Å; I1167-L1171 WeakPolarHBondContact O-CG 3.29Å; I1167-L1171 PolarHBondContact O-N 2.95Å; I1167-L1194 HydrophobicContact CD1-CD2 4.25Å; I1167-L1194 HydrophobicContact CG1-CD2 4.46Å
1168	W	93.1	Very high	89.6	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-58.9	-46.4	176	169.9	82.1	0	0	0	111.7	L583 L613 Y614 Q617 E1164 L1165 I1170 L1171 V1172 K1174	L583-W1168 HydrophobicContact CB-CH2 4.1Å; L583-W1168 HydrophobicContact CD2-CZ3 4.23Å; L583-W1168 WeakPolarHBondContact O-CH2 3.29Å; L613-W1168 HydrophobicContact CB-CZ2 4.46Å; L613-W1168 HydrophobicContact CD2-CZ2 4.23Å; Y614-W1168 AromaticContact CD1-CD1 3.73Å; Y614-W1168 HydrophobicContact CE1-CB 4.35Å; Y614-W1168 AromaticContact CE1-CD1 3.62Å; Y614-W1168 HydrophobicContact CE1-CG 4.37Å; Y614-W1168 HydrophobicContact CE2-CB 4.35Å; Y614-W1168 AromaticContact CG-CD1 3.97Å; Y614-W1168 AromaticContact CZ-CD1 3.76Å; Y614-W1168 WeakPolarHBondContact OH-CA 3.44Å; Q617-W1168 HydrophobicContact CG-CZ2 3.81Å; E1164-W1168 WeakPolarHBondContact O-CB 3.48Å; E1164-W1168 PolarHBondContact O-N 3.01Å; L1165-W1168 HydrophobicContact CD2-CE3 4.22Å; W1168-I1170 VanDerWaalsContact C-N 3.33Å; W1168-I1170 PolarHBondContact O-N 3.3Å; W1168-L1171 PolarHBondContact O-N 3.2Å; W1168-V1172 HydrophobicContact CG-CG2 4.45Å; W1168-V1172 WeakPolarHBondContact O-CB 3.39Å; W1168-V1172 VanDerWaalsContact O-CG2 3.29Å; W1168-V1172 WeakPolarHBondContact O-CG2 3.37Å; W1168-V1172 PolarHBondContact O-N 3.3Å; W1168-K1174 HydrophobicContact CH2-CD 3.91Å; W1168-K1174 HydrophobicContact CZ2-CD 4.37Å; W1168-K1174 HydrophobicContact CZ3-CD 4.29Å
1169	S	92.3	Very high	90.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.9	-41	179.2	-56.9	0	0	0	0	112	L1165 L1166 I1167 G1173 K1174	L1165-S1169 WeakPolarHBondContact O-CB 3.46Å; L1165-S1169 PolarHBondContact O-N 3Å; L1165-S1169 PolarHBondContact O-OG 3.19Å; L1166-S1169 PolarHBondContact O-N 3.35Å; I1167-S1169 PolarHBondContact O-N 2.94Å; S1169-G1173 PolarHBondContact O-N 2.78Å; S1169-G1173 VanDerWaalsContact O-N 3.15Å; S1169-K1174 PolarHBondContact O-N 3.37Å
1170	I	92.5	Very high	90.7	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-67.3	-45.8	177.8	-66.7	167	0	0	0	111.5	L1166 I1167 W1168 V1172 G1173 A1178 A1195 L1198 L1199 L1202	L1166-I1170 HydrophobicContact CD1-CD1 4.11Å; L1166-I1170 HydrophobicContact CG-CD1 4.15Å; L1166-I1170 WeakPolarHBondContact O-CG1 3.5Å; L1166-I1170 PolarHBondContact O-N 3.49Å; L1166-I1170 VanDerWaalsContact O-N 3.1Å; I1167-I1170 PolarHBondContact O-N 3.1Å; W1168-I1170 VanDerWaalsContact C-N 3.33Å; W1168-I1170 PolarHBondContact O-N 3.3Å; I1170-V1172 PolarHBondContact O-N 2.85Å; I1170-G1173 PolarHBondContact O-N 3.42Å; I1170-A1178 HydrophobicContact CG1-CB 3.85Å; I1170-A1195 HydrophobicContact CD1-CB 3.52Å; I1170-L1198 HydrophobicContact CG2-CB 3.98Å; I1170-L1199 HydrophobicContact CG2-CD2 3.93Å; I1170-L1199 HydrophobicContact CG2-CG 4.05Å; I1170-L1202 HydrophobicContact CG2-CD1 4Å
1171	L	90.6	Very high	91.1	Very high	4 Å²	4	13.9 Å²	13.9	2%	0.021	7%	0.066	C	C	.	.	H	α-helix	trans	-68.6	-32.5	-178.3	-69.5	177.5	0	0	0	113.1	Y614 F628 V648 I652 L655 I1167 W1168	Y614-L1171 HydrophobicContact CE1-CD1 4.23Å; F628-L1171 WeakPolarHBondContact CB-O 3.48Å; F628-L1171 HydrophobicContact CD2-CB 4.09Å; F628-L1171 HydrophobicContact CD2-CD1 4.49Å; F628-L1171 HydrophobicContact CE2-CB 4.4Å; F628-L1171 HydrophobicContact CE2-CD1 4.14Å; V648-L1171 HydrophobicContact CG1-CD1 3.89Å; I652-L1171 HydrophobicContact CG1-CD1 4.28Å; L655-L1171 HydrophobicContact CD1-CD2 3.67Å; I1167-L1171 HydrophobicContact CG2-CD1 3.9Å; I1167-L1171 HydrophobicContact CG2-CG 4.32Å; I1167-L1171 WeakPolarHBondContact O-CG 3.29Å; I1167-L1171 PolarHBondContact O-N 2.95Å; W1168-L1171 PolarHBondContact O-N 3.2Å
1172	V	88.2	Confident	91.3	Very high	6 Å²	6	13.6 Å²	13.6	4%	0.036	6%	0.064	C	C	.	.	H	α-helix	trans	-82.8	-14.4	177.9	177.7	0	0	0	0	111.9	Q617 V625 W1168 I1170 K1174	Q617-V1172 HydrophobicContact CB-CG1 4.33Å; Q617-V1172 HydrophobicContact CB-CG2 4.43Å; Q617-V1172 HydrophobicContact CG-CG1 4.16Å; Q617-V1172 HydrophobicContact CG-CG2 4.44Å; V625-V1172 HydrophobicContact CG2-CG1 3.79Å; V625-V1172 WeakPolarHBondContact CG2-O 3.44Å; W1168-V1172 HydrophobicContact CG-CG2 4.45Å; W1168-V1172 WeakPolarHBondContact O-CB 3.39Å; W1168-V1172 VanDerWaalsContact O-CG2 3.29Å; W1168-V1172 WeakPolarHBondContact O-CG2 3.37Å; W1168-V1172 PolarHBondContact O-N 3.3Å; I1170-V1172 PolarHBondContact O-N 2.85Å; V1172-K1174 HydrophobicContact CB-CD 4.3Å; V1172-K1174 HydrophobicContact CG1-CD 3.71Å; V1172-K1174 HydrophobicContact CG1-CG 4.11Å
1173	G	86.4	Confident	91.2	Very high	8 Å²	8	15.4 Å²	15.4	8%	0.082	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	17.4	-179.3	0	0	0	0	0	114.9	K624 S1169 I1170 L1175	K624-G1173 WeakPolarHBondContact CD-O 3.23Å; S1169-G1173 PolarHBondContact O-N 2.78Å; S1169-G1173 VanDerWaalsContact O-N 3.15Å; I1170-G1173 PolarHBondContact O-N 3.42Å; G1173-L1175 PolarHBondContact O-N 3.11Å
1174	K	89.6	Confident	91	Very high	20 Å²	20	17.8 Å²	17.8	9%	0.087	9%	0.086	C	C	.	.			trans	-87.9	71.7	177.2	-69.2	163.1	165.2	-108.4	0	110.4	L583 M584 D586 W1168 S1169 V1172 R1176 M1177 A1178	L583-K1174 PolarHBondContact O-NZ 2.97Å; M584-K1174 PolarHBondContact O-NZ 3.15Å; D586-K1174 WeakPolarHBondContact OD1-CD 3.3Å; D586-K1174 WeakPolarHBondContact OD1-CE 3.46Å; D586-K1174 WeakPolarHBondContact OD1-CG 3.35Å; D586-K1174 IonicContact OD1-NZ 2.72Å; D586-K1174 PolarHBondContact OD1-NZ 3.48Å; W1168-K1174 HydrophobicContact CH2-CD 3.91Å; W1168-K1174 HydrophobicContact CZ2-CD 4.37Å; W1168-K1174 HydrophobicContact CZ3-CD 4.29Å; S1169-K1174 PolarHBondContact O-N 3.37Å; V1172-K1174 HydrophobicContact CB-CD 4.3Å; V1172-K1174 HydrophobicContact CG1-CD 3.71Å; V1172-K1174 HydrophobicContact CG1-CG 4.11Å; K1174-R1176 PolarHBondContact O-N 2.86Å; K1174-M1177 HydrophobicContact CB-CB 4.33Å; K1174-M1177 PolarHBondContact O-N 3.38Å; K1174-A1178 PolarHBondContact O-N 3.36Å
1175	L	90.2	Very high	91	Very high	13 Å²	13	17.8 Å²	17.8	7%	0.068	9%	0.086	C	C	.	.	H	α-helix	trans	-65	-36.5	-167.2	-58.3	178.7	0	0	0	114	G1173 A1178 E1179 L1199 D1214 Y1215 F1218	G1173-L1175 PolarHBondContact O-N 3.11Å; L1175-A1178 WeakPolarHBondContact O-CB 3.39Å; L1175-A1178 PolarHBondContact O-N 2.96Å; L1175-E1179 PolarHBondContact O-N 3.47Å; L1175-L1199 HydrophobicContact CD2-CD2 3.53Å; L1175-D1214 HydrophobicContact CD1-CB 4.12Å; L1175-Y1215 HydrophobicContact CD1-CD1 4.13Å; L1175-Y1215 HydrophobicContact CD1-CE1 4.33Å; L1175-Y1215 HydrophobicContact CD2-CD1 4.04Å; L1175-Y1215 HydrophobicContact CD2-CE1 4.05Å; L1175-F1218 HydrophobicContact CB-CD1 3.97Å; L1175-F1218 HydrophobicContact CB-CD2 4.11Å; L1175-F1218 HydrophobicContact CB-CE1 3.75Å; L1175-F1218 HydrophobicContact CB-CE2 3.88Å; L1175-F1218 HydrophobicContact CB-CG 4.14Å; L1175-F1218 HydrophobicContact CB-CZ 3.7Å; L1175-F1218 HydrophobicContact CD1-CD2 3.53Å; L1175-F1218 HydrophobicContact CD1-CE2 3.77Å; L1175-F1218 HydrophobicContact CD1-CG 4.02Å; L1175-F1218 HydrophobicContact CD1-CZ 4.46Å; L1175-F1218 HydrophobicContact CG-CD2 4.36Å; L1175-F1218 HydrophobicContact CG-CE2 4.47Å; L1175-F1218 HydrophobicContact CG-CG 4.5Å
1176	R	88.9	Confident	90.8	Very high	118 Å²	118	22.1 Å²	22.1	45%	0.445	11%	0.105	S	C	.	.	H	α-helix	trans	-66.6	-39.3	177.5	-67.7	-171.3	-178.4	-180	4.9	112.8	K1174 A1178 E1179 L1180	K1174-R1176 PolarHBondContact O-N 2.86Å; R1176-A1178 VanDerWaalsContact C-N 3.3Å; R1176-A1178 PolarHBondContact O-N 3.16Å; R1176-E1179 PolarHBondContact O-N 3.36Å; R1176-L1180 PolarHBondContact O-N 2.89Å
1177	M	90.8	Very high	90.6	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.2	-36.1	173.4	-75.7	-68	-165	0	0	112.1	D586 H588 V591 K1174 E1179 L1180 F1181	D586-M1177 WeakPolarHBondContact OD1-CG 3.43Å; H588-M1177 VanDerWaalsContact CA-CE 3.41Å; H588-M1177 HydrophobicContact CB-CE 3.97Å; H588-M1177 HydrophobicContact CB-SD 3.91Å; V591-M1177 HydrophobicContact CB-CE 4.08Å; V591-M1177 HydrophobicContact CB-SD 4.19Å; V591-M1177 HydrophobicContact CG1-SD 4.4Å; V591-M1177 HydrophobicContact CG2-CE 3.51Å; V591-M1177 HydrophobicContact CG2-SD 4.17Å; K1174-M1177 HydrophobicContact CB-CB 4.33Å; K1174-M1177 PolarHBondContact O-N 3.38Å; M1177-E1179 VanDerWaalsContact C-N 3.28Å; M1177-E1179 PolarHBondContact O-N 3.03Å; M1177-L1180 PolarHBondContact O-N 2.89Å; M1177-F1181 HydrophobicContact CB-CD2 4.43Å; M1177-F1181 HydrophobicContact CB-CE2 4.17Å; M1177-F1181 WeakPolarHBondContact O-CD2 3.46Å; M1177-F1181 PolarHBondContact O-N 3.4Å; M1177-F1181 HydrophobicContact SD-CE2 4.44Å
1178	A	92.7	Very high	90.7	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-37	177.5	0	0	0	0	0	112.1	L1166 I1170 K1174 L1175 R1176 F1181 W1182 F1222	L1166-A1178 HydrophobicContact CD1-CB 3.95Å; L1166-A1178 WeakPolarHBondContact CD1-O 3.45Å; I1170-A1178 HydrophobicContact CG1-CB 3.85Å; K1174-A1178 PolarHBondContact O-N 3.36Å; L1175-A1178 WeakPolarHBondContact O-CB 3.39Å; L1175-A1178 PolarHBondContact O-N 2.96Å; R1176-A1178 VanDerWaalsContact C-N 3.3Å; R1176-A1178 PolarHBondContact O-N 3.16Å; A1178-F1181 PolarHBondContact O-N 3.33Å; A1178-W1182 PolarHBondContact O-N 3.03Å; A1178-F1222 HydrophobicContact CB-CZ 4.25Å
1179	E	90.8	Very high	90.7	Very high	50 Å²	50	22 Å²	22	23%	0.234	10%	0.104	C	C	.	.	H	α-helix	trans	-65.3	-41.5	175.8	-53.2	-159.8	125.2	0	0	112.4	L1175 R1176 M1177 W1182 T1183 F1218 F1222 R1225	L1175-E1179 PolarHBondContact O-N 3.47Å; R1176-E1179 PolarHBondContact O-N 3.36Å; M1177-E1179 VanDerWaalsContact C-N 3.28Å; M1177-E1179 PolarHBondContact O-N 3.03Å; E1179-W1182 PolarHBondContact O-N 3.07Å; E1179-T1183 PolarHBondContact O-N 3.02Å; E1179-F1218 HydrophobicContact CG-CD1 4.36Å; E1179-F1218 HydrophobicContact CG-CE1 3.94Å; E1179-F1222 HydrophobicContact CG-CZ 4.29Å; E1179-R1225 VanDerWaalsContact CD-NH2 3.27Å; E1179-R1225 IonicContact OE1-CZ 3.75Å; E1179-R1225 VanDerWaalsContact OE1-CZ 3.22Å; E1179-R1225 IonicContact OE1-NH1 3.15Å; E1179-R1225 PolarHBondContact OE1-NH1 3.46Å; E1179-R1225 IonicContact OE1-NH2 2.85Å; E1179-R1225 PolarHBondContact OE1-NH2 3.03Å; E1179-R1225 IonicContact OE2-NH2 3.29Å
1180	L	90.8	Very high	90.7	Very high	33 Å²	33	22 Å²	22	17%	0.173	10%	0.104	C	C	.	.	H	α-helix	trans	-62.6	-42.9	176.2	-179.9	65.1	0	0	0	111.8	V591 K592 L595 R1176 M1177 W1182 T1183 M1184	V591-L1180 HydrophobicContact CB-CD2 4.2Å; V591-L1180 HydrophobicContact CG1-CD2 3.79Å; K592-L1180 HydrophobicContact CB-CD1 4.31Å; K592-L1180 HydrophobicContact CB-CD2 4.23Å; K592-L1180 HydrophobicContact CG-CD1 4.28Å; L595-L1180 HydrophobicContact CD1-CD2 4.09Å; L595-L1180 HydrophobicContact CD1-CG 4.36Å; R1176-L1180 PolarHBondContact O-N 2.89Å; M1177-L1180 PolarHBondContact O-N 2.89Å; L1180-W1182 VanDerWaalsContact C-N 3.31Å; L1180-W1182 PolarHBondContact O-N 2.82Å; L1180-T1183 PolarHBondContact O-N 3.13Å; L1180-T1183 PolarHBondContact O-OG1 3.18Å; L1180-M1184 HydrophobicContact CG-CE 4.32Å; L1180-M1184 WeakPolarHBondContact O-CE 3.23Å
1181	F	92.8	Very high	90.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-72.5	-24.1	178.6	-67.8	-58.8	0	0	0	113.5	L583 V591 L601 L1165 L1166 M1177 A1178 M1184 E1185	L583-F1181 HydrophobicContact CD2-CE2 4.2Å; L583-F1181 HydrophobicContact CD2-CZ 3.76Å; V591-F1181 HydrophobicContact CG1-CZ 4.16Å; L601-F1181 HydrophobicContact CD1-CE1 4.34Å; L1165-F1181 HydrophobicContact CB-CD1 3.77Å; L1165-F1181 HydrophobicContact CB-CD2 3.78Å; L1165-F1181 HydrophobicContact CB-CE1 3.87Å; L1165-F1181 HydrophobicContact CB-CE2 3.84Å; L1165-F1181 HydrophobicContact CB-CG 3.77Å; L1165-F1181 HydrophobicContact CB-CZ 3.91Å; L1165-F1181 HydrophobicContact CD1-CD1 4.06Å; L1165-F1181 HydrophobicContact CD1-CE1 3.49Å; L1165-F1181 VanDerWaalsContact CD1-CE1 3.49Å; L1165-F1181 HydrophobicContact CD1-CZ 3.79Å; L1165-F1181 HydrophobicContact CG-CE1 4.27Å; L1165-F1181 HydrophobicContact CG-CZ 4.29Å; L1166-F1181 HydrophobicContact CB-CB 4.01Å; M1177-F1181 HydrophobicContact CB-CD2 4.43Å; M1177-F1181 HydrophobicContact CB-CE2 4.17Å; M1177-F1181 WeakPolarHBondContact O-CD2 3.46Å; M1177-F1181 PolarHBondContact O-N 3.4Å; M1177-F1181 HydrophobicContact SD-CE2 4.44Å; A1178-F1181 PolarHBondContact O-N 3.33Å; F1181-M1184 HydrophobicContact CD1-CE 3.41Å; F1181-M1184 VanDerWaalsContact CD1-CE 3.41Å; F1181-M1184 HydrophobicContact CE1-CE 3.8Å; F1181-M1184 HydrophobicContact CG-CE 4.38Å; F1181-M1184 PolarHBondContact O-N 3.04Å; F1181-E1185 PolarHBondContact O-N 3.23Å
1182	W	93.5	Very high	91	Very high	4 Å²	4	21.7 Å²	21.7	2%	0.015	10%	0.103	C	C	.	.	H	α-helix	trans	-67.2	-37.6	173.9	179	76.8	0	0	0	112.4	L1166 A1178 E1179 L1180 M1184 E1185 P1188 A1192 F1222 R1225 V1229 L1744	L1166-W1182 HydrophobicContact CD1-CB 4.23Å; A1178-W1182 PolarHBondContact O-N 3.03Å; E1179-W1182 PolarHBondContact O-N 3.07Å; L1180-W1182 VanDerWaalsContact C-N 3.31Å; L1180-W1182 PolarHBondContact O-N 2.82Å; W1182-M1184 PolarHBondContact O-N 3.31Å; W1182-E1185 PolarHBondContact O-N 2.88Å; W1182-P1188 HydrophobicContact CZ2-CB 4.02Å; W1182-P1188 PolarHBondContact NE1-O 3.16Å; W1182-A1192 HydrophobicContact CZ2-CB 4.36Å; W1182-F1222 HydrophobicContact CB-CE1 3.89Å; W1182-F1222 HydrophobicContact CG-CD1 4.36Å; W1182-F1222 AromaticContact CG-CE1 3.91Å; W1182-F1222 HydrophobicContact CG-CE1 3.91Å; W1182-R1225 HydrophobicContact CH2-CB 3.64Å; W1182-R1225 HydrophobicContact CH2-CG 3.94Å; W1182-R1225 HydrophobicContact CZ2-CB 3.77Å; W1182-R1225 HydrophobicContact CZ2-CG 4.48Å; W1182-R1225 HydrophobicContact CZ3-CB 4.24Å; W1182-R1225 HydrophobicContact CZ3-CG 4.07Å; W1182-V1229 HydrophobicContact CH2-CG2 4.08Å; W1182-V1229 HydrophobicContact CZ2-CG2 4.17Å; W1182-L1744 HydrophobicContact CZ3-CD1 4.5Å; W1182-L1744 HydrophobicContact CZ3-CD2 4.05Å
1183	T	89.2	Confident	91.3	Very high	49 Å²	49	21.4 Å²	21.4	30%	0.301	10%	0.101	S	C	.	.	H	α-helix	trans	-66	-22.6	178.7	66.1	0	0	0	0	113.2	E1179 L1180 M1741 L1744	E1179-T1183 PolarHBondContact O-N 3.02Å; L1180-T1183 PolarHBondContact O-N 3.13Å; L1180-T1183 PolarHBondContact O-OG1 3.18Å; T1183-M1741 WeakPolarHBondContact O-CE 3.27Å; T1183-L1744 HydrophobicContact CG2-CD1 3.84Å
1184	M	87.4	Confident	91.6	Very high	55 Å²	55	21.2 Å²	21.2	27%	0.271	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-3.9	178.1	-65.6	-176.4	-77.8	0	0	114.1	L595 L601 A1162 L1180 F1181 W1182	L595-M1184 HydrophobicContact CD1-CE 3.39Å; L595-M1184 HydrophobicContact CD1-SD 3.67Å; L595-M1184 HydrophobicContact CD2-CE 4.41Å; L595-M1184 HydrophobicContact CD2-SD 3.92Å; L595-M1184 HydrophobicContact CG-SD 4.29Å; L601-M1184 HydrophobicContact CD1-CE 3.96Å; L601-M1184 HydrophobicContact CD1-SD 3.89Å; A1162-M1184 HydrophobicContact CB-CB 4.1Å; L1180-M1184 HydrophobicContact CG-CE 4.32Å; L1180-M1184 WeakPolarHBondContact O-CE 3.23Å; F1181-M1184 HydrophobicContact CD1-CE 3.41Å; F1181-M1184 VanDerWaalsContact CD1-CE 3.41Å; F1181-M1184 HydrophobicContact CE1-CE 3.8Å; F1181-M1184 HydrophobicContact CG-CE 4.38Å; F1181-M1184 PolarHBondContact O-N 3.04Å; W1182-M1184 PolarHBondContact O-N 3.31Å
1185	E	91.5	Very high	91.8	Very high	3 Å²	3	20.3 Å²	20.3	1%	0.014	9%	0.094	C	C	.	.			trans	-77.1	144.4	-175.7	-153.8	-68.8	130.2	0	0	111.1	R1160 R1163 F1181 W1182 E1187 A1191 Y1252 H1737	R1160-E1185 IonicContact CZ-OE1 3.26Å; R1160-E1185 IonicContact NH1-OE1 3.06Å; R1160-E1185 PolarHBondContact NH1-OE1 3.01Å; R1163-E1185 HydrophobicContact CB-CG 4.34Å; F1181-E1185 PolarHBondContact O-N 3.23Å; W1182-E1185 PolarHBondContact O-N 2.88Å; E1185-E1187 VanDerWaalsContact CD-N 3.28Å; E1185-E1187 PolarHBondContact OE1-N 2.97Å; E1185-E1187 WeakPolarHBondContact OE2-CA 3.33Å; E1185-E1187 PolarHBondContact OE2-N 2.79Å; E1185-A1191 HydrophobicContact CB-CB 4.26Å; E1185-A1191 HydrophobicContact CG-CB 3.92Å; E1185-Y1252 PolarHBondContact OE1-OH 2.97Å; E1185-Y1252 PolarHBondContact OE2-OH 2.86Å; E1185-H1737 PolarHBondContact O-CE1 3.23Å; E1185-H1737 PolarHBondContact O-ND1 3.36Å
1186	K	89.3	Confident	92	Very high	90 Å²	90	19.9 Å²	19.9	39%	0.391	9%	0.092	S	C	.	.	S	Bend	trans	-81.3	-24.4	-171.2	-66.8	176.4	-178.6	168.1	0	113.6	E602 P1188 V1733	E602-K1186 IonicContact OE1-NZ 3.58Å; K1186-P1188 VanDerWaalsContact C-CD 3.47Å; K1186-V1733 HydrophobicContact CB-CG1 4.03Å; K1186-V1733 WeakPolarHBondContact O-CG1 3.36Å
1187	E	90.5	Very high	92.2	Very high	3 Å²	3	14.8 Å²	14.8	1%	0.014	7%	0.074	C	C	.	.	S	Bend	trans	-123.3	65.9	177.1	-70.9	168.9	174.1	0	0	111.1	R1160 E1185 I1189 A1190 A1191 L1249 Y1252 V1733	R1160-E1187 IonicContact CZ-OE1 3.3Å; R1160-E1187 IonicContact CZ-OE2 2.79Å; R1160-E1187 VanDerWaalsContact CZ-OE2 3.29Å; R1160-E1187 VanDerWaalsContact NH1-CG 3.31Å; R1160-E1187 IonicContact NH1-OE1 3.57Å; R1160-E1187 IonicContact NH1-OE2 2.74Å; R1160-E1187 PolarHBondContact NH1-OE2 3.5Å; R1160-E1187 IonicContact NH2-OE1 3.62Å; R1160-E1187 PolarHBondContact NH2-OE1 3.04Å; R1160-E1187 IonicContact NH2-OE2 2.98Å; R1160-E1187 PolarHBondContact NH2-OE2 3.27Å; R1160-E1187 VanDerWaalsContact NH2-OE2 3.15Å; E1185-E1187 VanDerWaalsContact CD-N 3.28Å; E1185-E1187 PolarHBondContact OE1-N 2.97Å; E1185-E1187 WeakPolarHBondContact OE2-CA 3.33Å; E1185-E1187 PolarHBondContact OE2-N 2.79Å; E1187-I1189 VanDerWaalsContact C-N 3.25Å; E1187-I1189 PolarHBondContact O-N 2.88Å; E1187-I1189 VanDerWaalsContact O-N 3.13Å; E1187-A1190 HydrophobicContact CB-CB 4.38Å; E1187-A1190 PolarHBondContact O-N 3.18Å; E1187-A1190 VanDerWaalsContact O-N 3.11Å; E1187-A1191 PolarHBondContact O-N 2.7Å; E1187-A1191 VanDerWaalsContact O-N 3.1Å; E1187-L1249 HydrophobicContact CG-CD2 4.46Å; E1187-Y1252 HydrophobicContact CB-CE2 4.15Å; E1187-Y1252 WeakPolarHBondContact OE2-CE2 3.43Å; E1187-V1733 HydrophobicContact CG-CG1 3.98Å; E1187-V1733 HydrophobicContact CG-CG2 4.13Å
1188	P	93.1	Very high	92.3	Very high	3 Å²	3	14.9 Å²	14.9	2%	0.019	7%	0.074	C	C	.	.	H	α-helix	trans	-60.1	-29.5	-166.3	20.8	-32.5	0	0	0	114.1	W1182 K1186 A1192 V1229 E1736 A1740	W1182-P1188 HydrophobicContact CZ2-CB 4.02Å; W1182-P1188 PolarHBondContact NE1-O 3.16Å; K1186-P1188 VanDerWaalsContact C-CD 3.47Å; P1188-A1192 WeakPolarHBondContact O-CB 3.49Å; P1188-A1192 PolarHBondContact O-N 2.64Å; P1188-V1229 HydrophobicContact CG-CG1 4.35Å; P1188-E1736 WeakPolarHBondContact CD-OE1 3.39Å; P1188-E1736 HydrophobicContact CG-CG 4.3Å; P1188-A1740 HydrophobicContact CB-CB 4.06Å; P1188-A1740 HydrophobicContact CG-CB 3.38Å
1189	I	93.9	Very high	92.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-66.3	-46.6	178.6	-57.3	173.4	0	0	0	109.9	E1187 A1192 L1193 A1226 V1229 L1230 V1257 F1269 E1736	E1187-I1189 VanDerWaalsContact C-N 3.25Å; E1187-I1189 PolarHBondContact O-N 2.88Å; E1187-I1189 VanDerWaalsContact O-N 3.13Å; I1189-A1192 PolarHBondContact O-N 3.08Å; I1189-L1193 HydrophobicContact CG2-CD1 4.36Å; I1189-L1193 WeakPolarHBondContact O-CG 3.5Å; I1189-L1193 PolarHBondContact O-N 3.42Å; I1189-L1193 VanDerWaalsContact O-N 3.13Å; I1189-A1226 HydrophobicContact CG2-CB 4.46Å; I1189-V1229 HydrophobicContact CD1-CG1 4.09Å; I1189-V1229 HydrophobicContact CG1-CB 4.1Å; I1189-V1229 HydrophobicContact CG1-CG1 3.67Å; I1189-L1230 HydrophobicContact CD1-CB 4.46Å; I1189-V1257 HydrophobicContact CG2-CG1 3.58Å; I1189-F1269 HydrophobicContact CG2-CE2 3.81Å; I1189-F1269 HydrophobicContact CG2-CZ 3.72Å; I1189-E1736 WeakPolarHBondContact CB-OE1 3.28Å; I1189-E1736 HydrophobicContact CD1-CG 4.17Å; I1189-E1736 HydrophobicContact CG1-CG 4.42Å; I1189-E1736 WeakPolarHBondContact CG1-OE1 3.41Å; I1189-E1736 PolarHBondContact N-OE1 3.37Å
1190	A	92.9	Very high	92.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-67	-39.8	178.5	0	0	0	0	0	112.1	E1187 L1193 L1194 L1249 Y1252	E1187-A1190 HydrophobicContact CB-CB 4.38Å; E1187-A1190 PolarHBondContact O-N 3.18Å; E1187-A1190 VanDerWaalsContact O-N 3.11Å; A1190-L1193 PolarHBondContact O-N 3.43Å; A1190-L1194 WeakPolarHBondContact O-CB 3.33Å; A1190-L1194 PolarHBondContact O-N 3.41Å; A1190-L1249 HydrophobicContact CB-CD1 3.52Å; A1190-L1249 HydrophobicContact CB-CD2 4.21Å; A1190-L1249 HydrophobicContact CB-CG 4.48Å; A1190-Y1252 HydrophobicContact CB-CD1 4.07Å; A1190-Y1252 HydrophobicContact CB-CD2 3.71Å; A1190-Y1252 HydrophobicContact CB-CE1 4.17Å; A1190-Y1252 HydrophobicContact CB-CE2 3.81Å; A1190-Y1252 HydrophobicContact CB-CG 3.87Å
1191	A	93.8	Very high	92.3	Very high	1 Å²	1	15 Å²	15	1%	0.008	8%	0.081	C	C	.	.	H	α-helix	trans	-59.3	-47.4	176	0	0	0	0	0	112.3	L1166 E1185 E1187 L1194 A1195 Y1252	L1166-A1191 HydrophobicContact CD2-CB 3.93Å; E1185-A1191 HydrophobicContact CB-CB 4.26Å; E1185-A1191 HydrophobicContact CG-CB 3.92Å; E1187-A1191 PolarHBondContact O-N 2.7Å; E1187-A1191 VanDerWaalsContact O-N 3.1Å; A1191-L1194 PolarHBondContact O-N 2.78Å; A1191-A1195 WeakPolarHBondContact O-CB 3.4Å; A1191-A1195 PolarHBondContact O-N 2.78Å; A1191-Y1252 HydrophobicContact CB-CE1 4.33Å; A1191-Y1252 VanDerWaalsContact CB-OH 3.31Å; A1191-Y1252 WeakPolarHBondContact CB-OH 3.48Å
1192	A	94.6	Very high	92.1	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64.5	-44.2	179.3	0	0	0	0	0	112.5	W1182 P1188 I1189 A1195 S1196 F1222 A1226	W1182-A1192 HydrophobicContact CZ2-CB 4.36Å; P1188-A1192 WeakPolarHBondContact O-CB 3.49Å; P1188-A1192 PolarHBondContact O-N 2.64Å; I1189-A1192 PolarHBondContact O-N 3.08Å; A1192-A1195 PolarHBondContact O-N 3.18Å; A1192-S1196 WeakPolarHBondContact O-CB 3.06Å; A1192-S1196 PolarHBondContact O-N 3.03Å; A1192-F1222 HydrophobicContact CB-CD1 4.43Å; A1192-F1222 WeakPolarHBondContact CB-O 3.46Å; A1192-A1226 HydrophobicContact CB-CB 3.74Å
1193	L	94.5	Very high	91.8	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.6	-44.3	176.6	-69.6	173.6	0	0	0	111.8	I1189 A1190 A1195 S1196 I1197 A1226 V1257 A1261 F1269	I1189-L1193 HydrophobicContact CG2-CD1 4.36Å; I1189-L1193 WeakPolarHBondContact O-CG 3.5Å; I1189-L1193 PolarHBondContact O-N 3.42Å; I1189-L1193 VanDerWaalsContact O-N 3.13Å; A1190-L1193 PolarHBondContact O-N 3.43Å; L1193-A1195 VanDerWaalsContact C-N 3.32Å; L1193-A1195 PolarHBondContact O-N 2.84Å; L1193-S1196 PolarHBondContact O-N 2.9Å; L1193-I1197 VanDerWaalsContact O-CG1 3.26Å; L1193-I1197 WeakPolarHBondContact O-CG1 3.1Å; L1193-I1197 PolarHBondContact O-N 2.98Å; L1193-A1226 HydrophobicContact CD2-CB 4.11Å; L1193-A1226 HydrophobicContact CG-CB 4.12Å; L1193-V1257 HydrophobicContact CD1-CG1 3.61Å; L1193-A1261 HydrophobicContact CD1-CB 3.99Å; L1193-A1261 HydrophobicContact CD2-CB 4.29Å; L1193-F1269 HydrophobicContact CD1-CE1 4.13Å; L1193-F1269 HydrophobicContact CD1-CE2 4.42Å; L1193-F1269 HydrophobicContact CD1-CZ 4.07Å; L1193-F1269 HydrophobicContact CD2-CD2 4.21Å; L1193-F1269 HydrophobicContact CD2-CG 4.19Å
1194	L	93.4	Very high	91.7	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.016	9%	0.093	C	C	.	.	H	α-helix	trans	-61.4	-41.9	176.1	-178.5	67.4	0	0	0	111.5	V656 Y660 I1167 A1190 A1191 I1197 L1198 Y1252	V656-L1194 HydrophobicContact CG2-CD1 3.94Å; Y660-L1194 HydrophobicContact CD2-CD1 4.46Å; Y660-L1194 HydrophobicContact CE1-CD1 4.46Å; Y660-L1194 HydrophobicContact CE2-CD1 3.86Å; Y660-L1194 WeakPolarHBondContact OH-CD2 3.3Å; I1167-L1194 HydrophobicContact CD1-CD2 4.25Å; I1167-L1194 HydrophobicContact CG1-CD2 4.46Å; A1190-L1194 WeakPolarHBondContact O-CB 3.33Å; A1190-L1194 PolarHBondContact O-N 3.41Å; A1191-L1194 PolarHBondContact O-N 2.78Å; L1194-I1197 PolarHBondContact O-N 3.37Å; L1194-L1198 HydrophobicContact CD1-CD1 4.48Å; L1194-L1198 HydrophobicContact CD1-CG 4.47Å; L1194-L1198 HydrophobicContact CG-CD1 4.13Å; L1194-L1198 WeakPolarHBondContact O-CG 3.2Å; L1194-L1198 PolarHBondContact O-N 3.33Å; L1194-Y1252 HydrophobicContact CB-CD1 4.09Å; L1194-Y1252 HydrophobicContact CB-CE1 4.23Å; L1194-Y1252 HydrophobicContact CD2-CD1 3.77Å; L1194-Y1252 HydrophobicContact CD2-CE1 3.92Å; L1194-Y1252 HydrophobicContact CG-CD1 4.5Å
1195	A	94.4	Very high	91.5	Very high	1 Å²	1	19 Å²	19	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-45	177	0	0	0	0	0	111.9	I1170 A1191 A1192 L1193 I1197 L1198 L1199 F1222	I1170-A1195 HydrophobicContact CD1-CB 3.52Å; A1191-A1195 WeakPolarHBondContact O-CB 3.4Å; A1191-A1195 PolarHBondContact O-N 2.78Å; A1192-A1195 PolarHBondContact O-N 3.18Å; L1193-A1195 VanDerWaalsContact C-N 3.32Å; L1193-A1195 PolarHBondContact O-N 2.84Å; A1195-I1197 VanDerWaalsContact C-N 3.34Å; A1195-I1197 PolarHBondContact O-N 2.7Å; A1195-L1198 PolarHBondContact O-N 3.33Å; A1195-L1199 WeakPolarHBondContact O-CB 3.2Å; A1195-L1199 VanDerWaalsContact O-CG 3.29Å; A1195-L1199 WeakPolarHBondContact O-CG 3.34Å; A1195-L1199 PolarHBondContact O-N 3Å; A1195-F1222 HydrophobicContact CB-CB 4.33Å; A1195-F1222 HydrophobicContact CB-CD1 4.03Å; A1195-F1222 HydrophobicContact CB-CD2 3.95Å; A1195-F1222 HydrophobicContact CB-CE1 4.32Å; A1195-F1222 HydrophobicContact CB-CE2 4.25Å; A1195-F1222 HydrophobicContact CB-CG 3.84Å; A1195-F1222 HydrophobicContact CB-CZ 4.43Å
1196	S	94.1	Very high	91	Very high	4 Å²	4	19.4 Å²	19.4	3%	0.028	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-42.8	176.4	-173.2	0	0	0	0	112.2	A1192 L1193 T1200 A1219	A1192-S1196 WeakPolarHBondContact O-CB 3.06Å; A1192-S1196 PolarHBondContact O-N 3.03Å; L1193-S1196 PolarHBondContact O-N 2.9Å; S1196-T1200 WeakPolarHBondContact O-CB 3.19Å; S1196-T1200 PolarHBondContact O-N 3.16Å; S1196-T1200 PolarHBondContact O-OG1 3.14Å; S1196-A1219 WeakPolarHBondContact CB-O 3.34Å; S1196-A1219 PolarHBondContact OG-O 3.25Å
1197	I	92.7	Very high	90.5	Very high	12 Å²	12	22.7 Å²	22.7	6%	0.062	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-48	176.9	-63.2	166.2	0	0	0	111.2	V656 L1193 L1194 A1195 T1200 S1201 G1264	V656-I1197 HydrophobicContact CG1-CG2 4.18Å; V656-I1197 HydrophobicContact CG2-CG2 4.47Å; L1193-I1197 VanDerWaalsContact O-CG1 3.26Å; L1193-I1197 WeakPolarHBondContact O-CG1 3.1Å; L1193-I1197 PolarHBondContact O-N 2.98Å; L1194-I1197 PolarHBondContact O-N 3.37Å; A1195-I1197 VanDerWaalsContact C-N 3.34Å; A1195-I1197 PolarHBondContact O-N 2.7Å; I1197-T1200 PolarHBondContact O-N 2.95Å; I1197-S1201 WeakPolarHBondContact O-CB 3.5Å; I1197-S1201 PolarHBondContact O-N 3.46Å; I1197-S1201 PolarHBondContact O-OG 2.69Å; I1197-G1264 VanDerWaalsContact CG1-CA 3.5Å
1198	L	92.2	Very high	90	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-45.2	-179.8	-74.4	173.9	0	0	0	111.9	L655 V656 I1170 L1194 A1195 S1201 L1202	L655-L1198 HydrophobicContact CB-CD2 3.79Å; L655-L1198 HydrophobicContact CD1-CD2 4.08Å; V656-L1198 HydrophobicContact CG2-CD2 3.62Å; V656-L1198 HydrophobicContact CG2-CG 4.23Å; I1170-L1198 HydrophobicContact CG2-CB 3.98Å; L1194-L1198 HydrophobicContact CD1-CD1 4.48Å; L1194-L1198 HydrophobicContact CD1-CG 4.47Å; L1194-L1198 HydrophobicContact CG-CD1 4.13Å; L1194-L1198 WeakPolarHBondContact O-CG 3.2Å; L1194-L1198 PolarHBondContact O-N 3.33Å; A1195-L1198 PolarHBondContact O-N 3.33Å; L1198-S1201 PolarHBondContact O-N 2.8Å; L1198-L1202 WeakPolarHBondContact O-CB 3.06Å; L1198-L1202 VanDerWaalsContact O-CG 3.31Å; L1198-L1202 WeakPolarHBondContact O-CG 3.42Å; L1198-L1202 PolarHBondContact O-N 3.35Å
1199	L	92.7	Very high	89.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-41	178.6	-72	166.6	0	0	0	112.1	I1170 L1175 A1195 S1201 L1202 G1203 Y1215 F1218 A1219 F1222	I1170-L1199 HydrophobicContact CG2-CD2 3.93Å; I1170-L1199 HydrophobicContact CG2-CG 4.05Å; L1175-L1199 HydrophobicContact CD2-CD2 3.53Å; A1195-L1199 WeakPolarHBondContact O-CB 3.2Å; A1195-L1199 VanDerWaalsContact O-CG 3.29Å; A1195-L1199 WeakPolarHBondContact O-CG 3.34Å; A1195-L1199 PolarHBondContact O-N 3Å; L1199-S1201 VanDerWaalsContact C-N 3.31Å; L1199-S1201 PolarHBondContact O-N 3.16Å; L1199-L1202 PolarHBondContact O-N 3.26Å; L1199-G1203 PolarHBondContact O-N 3.38Å; L1199-Y1215 HydrophobicContact CD2-CD1 3.67Å; L1199-Y1215 HydrophobicContact CD2-CE1 4.38Å; L1199-Y1215 HydrophobicContact CD2-CG 4.47Å; L1199-F1218 HydrophobicContact CD1-CB 3.87Å; L1199-A1219 HydrophobicContact CB-CB 3.81Å; L1199-F1222 HydrophobicContact CD1-CD2 3.63Å; L1199-F1222 HydrophobicContact CD1-CE2 3.86Å
1200	T	92.1	Very high	88.8	Confident	57 Å²	57	37.1 Å²	37.1	35%	0.35	20%	0.196	S	C	.	.	H	α-helix	trans	-61.5	-42.1	174.3	-58.1	0	0	0	0	111	S1196 I1197 N1204	S1196-T1200 WeakPolarHBondContact O-CB 3.19Å; S1196-T1200 PolarHBondContact O-N 3.16Å; S1196-T1200 PolarHBondContact O-OG1 3.14Å; I1197-T1200 PolarHBondContact O-N 2.95Å; T1200-N1204 WeakPolarHBondContact O-CB 3.35Å; T1200-N1204 PolarHBondContact O-N 3.25Å; T1200-N1204 PolarHBondContact O-ND2 3.42Å
1201	S	89.7	Confident	88.3	Confident	29 Å²	29	37.5 Å²	37.5	20%	0.203	20%	0.198	C	C	.	.	H	α-helix	trans	-68.4	-33.6	176.3	-72.3	0	0	0	0	113.6	L655 I1197 L1198 L1199 K1205	L655-S1201 WeakPolarHBondContact O-CB 3.2Å; L655-S1201 PolarHBondContact O-OG 3.14Å; I1197-S1201 WeakPolarHBondContact O-CB 3.5Å; I1197-S1201 PolarHBondContact O-N 3.46Å; I1197-S1201 PolarHBondContact O-OG 2.69Å; L1198-S1201 PolarHBondContact O-N 2.8Å; L1199-S1201 VanDerWaalsContact C-N 3.31Å; L1199-S1201 PolarHBondContact O-N 3.16Å; S1201-K1205 WeakPolarHBondContact O-CG 3.09Å
1202	L	88	Confident	87.9	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-72.4	-43.4	174	-73.4	168.2	0	0	0	111.6	I627 L655 I1170 L1198 L1199 N1204 K1205 T1206 Y1215	I627-L1202 HydrophobicContact CG2-CD2 4.15Å; L655-L1202 HydrophobicContact CD1-CD2 4.28Å; L655-L1202 HydrophobicContact CD2-CD2 4.22Å; L655-L1202 HydrophobicContact CD2-CG 4.47Å; I1170-L1202 HydrophobicContact CG2-CD1 4Å; L1198-L1202 WeakPolarHBondContact O-CB 3.06Å; L1198-L1202 VanDerWaalsContact O-CG 3.31Å; L1198-L1202 WeakPolarHBondContact O-CG 3.42Å; L1198-L1202 PolarHBondContact O-N 3.35Å; L1199-L1202 PolarHBondContact O-N 3.26Å; L1202-N1204 VanDerWaalsContact C-N 3.26Å; L1202-N1204 PolarHBondContact O-N 2.97Å; L1202-K1205 PolarHBondContact O-N 2.9Å; L1202-T1206 PolarHBondContact O-N 2.91Å; L1202-T1206 VanDerWaalsContact O-N 3.07Å; L1202-Y1215 HydrophobicContact CB-CD2 4.26Å; L1202-Y1215 HydrophobicContact CB-CE2 4.37Å; L1202-Y1215 HydrophobicContact CB-CG 4.49Å
1203	G	87.5	Confident	87.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-30.1	174.9	0	0	0	0	0	113.5	L1199 K1205 K1212	L1199-G1203 PolarHBondContact O-N 3.38Å; G1203-K1205 VanDerWaalsContact C-N 3.29Å; G1203-K1212 WeakPolarHBondContact O-CE 3.41Å; G1203-K1212 WeakPolarHBondContact O-CG 3.06Å
1204	N	86.6	Confident	87.3	Confident	100 Å²	100	47.9 Å²	47.9	54%	0.535	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-14.3	173.1	-70.9	-23.5	0	0	0	113.7	T1200 L1202	T1200-N1204 WeakPolarHBondContact O-CB 3.35Å; T1200-N1204 PolarHBondContact O-N 3.25Å; T1200-N1204 PolarHBondContact O-ND2 3.42Å; L1202-N1204 VanDerWaalsContact C-N 3.26Å; L1202-N1204 PolarHBondContact O-N 2.97Å
1205	K	84	Confident	87.2	Confident	89 Å²	89	47.8 Å²	47.8	39%	0.387	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-15.8	-179	-74.8	-178.1	-177.3	179.5	0	114.4	M631 L655 S1201 L1202 G1203	M631-K1205 HydrophobicContact CE-CD 4.46Å; M631-K1205 HydrophobicContact SD-CD 3.79Å; L655-K1205 HydrophobicContact CD2-CD 4.05Å; S1201-K1205 WeakPolarHBondContact O-CG 3.09Å; L1202-K1205 PolarHBondContact O-N 2.9Å; G1203-K1205 VanDerWaalsContact C-N 3.29Å
1206	T	82	Confident	87	Confident	10 Å²	10	53.4 Å²	53.4	6%	0.061	27%	0.268	C	S	.	.			trans	-83.1	137.5	175	-170.9	0	0	0	0	111.1	L1202 D1208 D1211 K1212 Y1215	L1202-T1206 PolarHBondContact O-N 2.91Å; L1202-T1206 VanDerWaalsContact O-N 3.07Å; T1206-D1208 PolarHBondContact OG1-N 2.93Å; T1206-D1211 HydrophobicContact CG2-CB 4.34Å; T1206-K1212 HydrophobicContact CG2-CB 3.65Å; T1206-K1212 HydrophobicContact CG2-CG 4.25Å; T1206-Y1215 HydrophobicContact CG2-CD2 4.15Å; T1206-Y1215 HydrophobicContact CG2-CE2 4.35Å
1207	D	76.9	Confident	86.8	Confident	159 Å²	159	55.3 Å²	55.3	85%	0.85	28%	0.281	S	S	*	.			trans	-90.1	-20.1	173.6	-62.6	-38.5	0	0	0	111.4	F1209	D1207-F1209 PolarHBondContact O-N 2.99Å
1208	D	80.1	Confident	86.8	Confident	73 Å²	73	56.4 Å²	56.4	39%	0.39	29%	0.286	S	S	.	.			trans	-74.6	121.3	175.2	-170.9	-19.5	0	0	0	110	T1206 T1210 D1211 K1212	T1206-D1208 PolarHBondContact OG1-N 2.93Å; D1208-T1210 VanDerWaalsContact C-N 3.29Å; D1208-T1210 PolarHBondContact O-N 2.79Å; D1208-T1210 PolarHBondContact OD1-N 2.96Å; D1208-T1210 PolarHBondContact OD1-OG1 2.84Å; D1208-T1210 PolarHBondContact OD2-OG1 3.2Å; D1208-D1211 HydrophobicContact CB-CB 4.31Å; D1208-K1212 VanDerWaalsContact O-CB 3.3Å; D1208-K1212 WeakPolarHBondContact O-CB 3.06Å; D1208-K1212 PolarHBondContact O-N 3.18Å
1209	F	79.9	Confident	86.9	Confident	148 Å²	148	56.6 Å²	56.6	65%	0.649	29%	0.287	S	S	*	.	H	α-helix	trans	-68	-30.4	-177.9	-149.3	-71.3	0	0	0	112.1	D1207 K1212 E1213	D1207-F1209 PolarHBondContact O-N 2.99Å; F1209-K1212 WeakPolarHBondContact O-CB 3.5Å; F1209-K1212 PolarHBondContact O-N 2.89Å; F1209-E1213 PolarHBondContact O-N 2.99Å
1210	T	82.1	Confident	86.8	Confident	88 Å²	88	62 Å²	62	54%	0.54	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-55.9	179.5	63	0	0	0	0	110.1	D1208 K1212 E1213 D1214	D1208-T1210 VanDerWaalsContact C-N 3.29Å; D1208-T1210 PolarHBondContact O-N 2.79Å; D1208-T1210 PolarHBondContact OD1-N 2.96Å; D1208-T1210 PolarHBondContact OD1-OG1 2.84Å; D1208-T1210 PolarHBondContact OD2-OG1 3.2Å; T1210-K1212 PolarHBondContact O-N 3.27Å; T1210-E1213 PolarHBondContact O-N 3.1Å; T1210-D1214 PolarHBondContact O-N 3.27Å
1211	D	82.5	Confident	86.8	Confident	8 Å²	8	62.3 Å²	62.3	4%	0.043	31%	0.31	C	S	.	.	H	α-helix	trans	-59.4	-35	174.8	-76.5	-23.5	0	0	0	112	K624 T1206 D1208 Y1215	K624-D1211 IonicContact NZ-OD1 2.98Å; K624-D1211 PolarHBondContact NZ-OD1 2.96Å; T1206-D1211 HydrophobicContact CG2-CB 4.34Å; D1208-D1211 HydrophobicContact CB-CB 4.31Å; D1211-Y1215 HydrophobicContact CB-CD2 4.45Å; D1211-Y1215 HydrophobicContact CB-CE2 4.02Å; D1211-Y1215 WeakPolarHBondContact O-CB 3.45Å; D1211-Y1215 WeakPolarHBondContact O-CD2 3.45Å; D1211-Y1215 PolarHBondContact O-N 2.98Å
1212	K	86.4	Confident	87	Confident	55 Å²	55	61 Å²	61	24%	0.239	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-44.9	177.5	-170.7	161.7	-174	171.3	0	113	G1203 T1206 D1208 F1209 T1210 R1216	G1203-K1212 WeakPolarHBondContact O-CE 3.41Å; G1203-K1212 WeakPolarHBondContact O-CG 3.06Å; T1206-K1212 HydrophobicContact CG2-CB 3.65Å; T1206-K1212 HydrophobicContact CG2-CG 4.25Å; D1208-K1212 VanDerWaalsContact O-CB 3.3Å; D1208-K1212 WeakPolarHBondContact O-CB 3.06Å; D1208-K1212 PolarHBondContact O-N 3.18Å; F1209-K1212 WeakPolarHBondContact O-CB 3.5Å; F1209-K1212 PolarHBondContact O-N 2.89Å; T1210-K1212 PolarHBondContact O-N 3.27Å; K1212-R1216 WeakPolarHBondContact O-CG 3.46Å; K1212-R1216 PolarHBondContact O-N 2.93Å; K1212-R1216 VanDerWaalsContact O-N 3.08Å
1213	E	87.5	Confident	87.3	Confident	99 Å²	99	62.3 Å²	62.3	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-70.9	-40.4	179.5	-166.2	58.7	-147.6	0	0	110.7	F1209 T1210 Y1215 R1216 S1217	F1209-E1213 PolarHBondContact O-N 2.99Å; T1210-E1213 PolarHBondContact O-N 3.1Å; E1213-Y1215 PolarHBondContact O-N 2.83Å; E1213-R1216 PolarHBondContact O-N 3.1Å; E1213-S1217 WeakPolarHBondContact O-CB 3.18Å; E1213-S1217 PolarHBondContact O-N 2.95Å; E1213-S1217 PolarHBondContact O-OG 3.3Å; E1213-S1217 VanDerWaalsContact O-OG 3.12Å
1214	D	87.5	Confident	87.5	Confident	65 Å²	65	65.9 Å²	65.9	35%	0.348	32%	0.324	S	S	.	.	H	α-helix	trans	-56	-50.7	171.2	-79.6	-4.2	0	0	0	111	K624 L1175 T1210 R1216 S1217 F1218	K624-D1214 IonicContact NZ-OD2 2.76Å; K624-D1214 PolarHBondContact NZ-OD2 3.23Å; L1175-D1214 HydrophobicContact CD1-CB 4.12Å; T1210-D1214 PolarHBondContact O-N 3.27Å; D1214-R1216 PolarHBondContact O-N 3.23Å; D1214-S1217 PolarHBondContact O-N 3.46Å; D1214-S1217 PolarHBondContact O-OG 2.93Å; D1214-F1218 VanDerWaalsContact O-CD2 3.32Å; D1214-F1218 WeakPolarHBondContact O-CD2 3.45Å; D1214-F1218 PolarHBondContact O-N 2.9Å; D1214-F1218 VanDerWaalsContact O-N 3.1Å
1215	Y	91.4	Very high	87.7	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-38.7	179.8	-66.5	-42.5	0	0	0	113.1	I627 L1175 L1199 L1202 T1206 D1211 E1213 A1219	I627-Y1215 HydrophobicContact CD1-CE2 4.19Å; L1175-Y1215 HydrophobicContact CD1-CD1 4.13Å; L1175-Y1215 HydrophobicContact CD1-CE1 4.33Å; L1175-Y1215 HydrophobicContact CD2-CD1 4.04Å; L1175-Y1215 HydrophobicContact CD2-CE1 4.05Å; L1199-Y1215 HydrophobicContact CD2-CD1 3.67Å; L1199-Y1215 HydrophobicContact CD2-CE1 4.38Å; L1199-Y1215 HydrophobicContact CD2-CG 4.47Å; L1202-Y1215 HydrophobicContact CB-CD2 4.26Å; L1202-Y1215 HydrophobicContact CB-CE2 4.37Å; L1202-Y1215 HydrophobicContact CB-CG 4.49Å; T1206-Y1215 HydrophobicContact CG2-CD2 4.15Å; T1206-Y1215 HydrophobicContact CG2-CE2 4.35Å; D1211-Y1215 HydrophobicContact CB-CD2 4.45Å; D1211-Y1215 HydrophobicContact CB-CE2 4.02Å; D1211-Y1215 WeakPolarHBondContact O-CB 3.45Å; D1211-Y1215 WeakPolarHBondContact O-CD2 3.45Å; D1211-Y1215 PolarHBondContact O-N 2.98Å; E1213-Y1215 PolarHBondContact O-N 2.83Å; Y1215-A1219 VanDerWaalsContact O-CB 3.27Å; Y1215-A1219 WeakPolarHBondContact O-CB 3.32Å; Y1215-A1219 PolarHBondContact O-N 3.3Å
1216	R	90.9	Very high	88.2	Confident	118 Å²	118	59.5 Å²	59.5	45%	0.445	29%	0.29	S	S	.	.	H	α-helix	trans	-69.5	-40.8	178.6	-77.3	-179.5	173	-176.4	-3	112.6	K1212 E1213 D1214 A1219 K1220	K1212-R1216 WeakPolarHBondContact O-CG 3.46Å; K1212-R1216 PolarHBondContact O-N 2.93Å; K1212-R1216 VanDerWaalsContact O-N 3.08Å; E1213-R1216 PolarHBondContact O-N 3.1Å; D1214-R1216 PolarHBondContact O-N 3.23Å; R1216-A1219 PolarHBondContact O-N 3.45Å; R1216-K1220 PolarHBondContact O-N 3.44Å; R1216-K1220 VanDerWaalsContact O-N 3.09Å
1217	S	91.1	Very high	88.6	Confident	44 Å²	44	62.2 Å²	62.2	31%	0.308	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-47.1	177.1	64.2	0	0	0	0	111.3	E1213 D1214 A1219 K1220 N1221	E1213-S1217 WeakPolarHBondContact O-CB 3.18Å; E1213-S1217 PolarHBondContact O-N 2.95Å; E1213-S1217 PolarHBondContact O-OG 3.3Å; E1213-S1217 VanDerWaalsContact O-OG 3.12Å; D1214-S1217 PolarHBondContact O-N 3.46Å; D1214-S1217 PolarHBondContact O-OG 2.93Å; S1217-A1219 PolarHBondContact O-N 3.26Å; S1217-K1220 PolarHBondContact O-N 2.75Å; S1217-N1221 PolarHBondContact O-N 2.93Å; S1217-N1221 PolarHBondContact O-OD1 3.44Å
1218	F	92.2	Very high	89.3	Confident	36 Å²	36	55.3 Å²	55.3	16%	0.158	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-37	175	-84.2	-94.2	0	0	0	112.6	L1175 E1179 L1199 D1214 K1220 N1221 F1222	L1175-F1218 HydrophobicContact CB-CD1 3.97Å; L1175-F1218 HydrophobicContact CB-CD2 4.11Å; L1175-F1218 HydrophobicContact CB-CE1 3.75Å; L1175-F1218 HydrophobicContact CB-CE2 3.88Å; L1175-F1218 HydrophobicContact CB-CG 4.14Å; L1175-F1218 HydrophobicContact CB-CZ 3.7Å; L1175-F1218 HydrophobicContact CD1-CD2 3.53Å; L1175-F1218 HydrophobicContact CD1-CE2 3.77Å; L1175-F1218 HydrophobicContact CD1-CG 4.02Å; L1175-F1218 HydrophobicContact CD1-CZ 4.46Å; L1175-F1218 HydrophobicContact CG-CD2 4.36Å; L1175-F1218 HydrophobicContact CG-CE2 4.47Å; L1175-F1218 HydrophobicContact CG-CG 4.5Å; E1179-F1218 HydrophobicContact CG-CD1 4.36Å; E1179-F1218 HydrophobicContact CG-CE1 3.94Å; L1199-F1218 HydrophobicContact CD1-CB 3.87Å; D1214-F1218 VanDerWaalsContact O-CD2 3.32Å; D1214-F1218 WeakPolarHBondContact O-CD2 3.45Å; D1214-F1218 PolarHBondContact O-N 2.9Å; D1214-F1218 VanDerWaalsContact O-N 3.1Å; F1218-K1220 VanDerWaalsContact C-N 3.3Å; F1218-K1220 PolarHBondContact O-N 2.94Å; F1218-N1221 PolarHBondContact O-N 3.01Å; F1218-F1222 HydrophobicContact CD1-CE2 4.43Å; F1218-F1222 VanDerWaalsContact O-CD2 3.22Å; F1218-F1222 WeakPolarHBondContact O-CD2 3.08Å; F1218-F1222 PolarHBondContact O-N 3.19Å
1219	A	93	Very high	89.9	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.033	25%	0.25	C	C	.	.	H	α-helix	trans	-60.6	-39.5	176.1	0	0	0	0	0	112.4	S1196 L1199 Y1215 R1216 S1217 Q1223	S1196-A1219 WeakPolarHBondContact CB-O 3.34Å; S1196-A1219 PolarHBondContact OG-O 3.25Å; L1199-A1219 HydrophobicContact CB-CB 3.81Å; Y1215-A1219 VanDerWaalsContact O-CB 3.27Å; Y1215-A1219 WeakPolarHBondContact O-CB 3.32Å; Y1215-A1219 PolarHBondContact O-N 3.3Å; R1216-A1219 PolarHBondContact O-N 3.45Å; S1217-A1219 PolarHBondContact O-N 3.26Å; A1219-Q1223 PolarHBondContact O-N 3.23Å; A1219-Q1223 VanDerWaalsContact O-N 3.15Å
1220	K	92.3	Very high	90.5	Very high	115 Å²	115	44.8 Å²	44.8	50%	0.5	22%	0.219	S	C	.	.	H	α-helix	trans	-67.2	-44.6	174.5	-175.7	-177.4	169.5	-169.6	0	111.4	R1216 S1217 F1218 F1222 Q1223 E1224	R1216-K1220 PolarHBondContact O-N 3.44Å; R1216-K1220 VanDerWaalsContact O-N 3.09Å; S1217-K1220 PolarHBondContact O-N 2.75Å; F1218-K1220 VanDerWaalsContact C-N 3.3Å; F1218-K1220 PolarHBondContact O-N 2.94Å; K1220-F1222 PolarHBondContact O-N 3.06Å; K1220-Q1223 WeakPolarHBondContact O-CB 3.48Å; K1220-Q1223 PolarHBondContact O-N 3.11Å; K1220-Q1223 VanDerWaalsContact O-N 3.12Å; K1220-E1224 WeakPolarHBondContact CE-OE1 3.08Å; K1220-E1224 PolarHBondContact O-N 3.11Å
1221	N	92.1	Very high	91	Very high	63 Å²	63	44.9 Å²	44.9	34%	0.337	22%	0.216	S	C	.	.	H	α-helix	trans	-59.6	-43	177.5	-68.4	-9.6	0	0	0	112.2	S1217 F1218 E1224 R1225	S1217-N1221 PolarHBondContact O-N 2.93Å; S1217-N1221 PolarHBondContact O-OD1 3.44Å; F1218-N1221 PolarHBondContact O-N 3.01Å; N1221-E1224 PolarHBondContact O-N 3.25Å; N1221-R1225 WeakPolarHBondContact O-CG 3.4Å; N1221-R1225 PolarHBondContact O-N 2.94Å
1222	F	93.8	Very high	91.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-38.7	174.7	-80.1	-68.4	0	0	0	112.1	A1178 E1179 W1182 A1192 A1195 L1199 F1218 K1220 R1225 A1226	A1178-F1222 HydrophobicContact CB-CZ 4.25Å; E1179-F1222 HydrophobicContact CG-CZ 4.29Å; W1182-F1222 HydrophobicContact CB-CE1 3.89Å; W1182-F1222 HydrophobicContact CG-CD1 4.36Å; W1182-F1222 AromaticContact CG-CE1 3.91Å; W1182-F1222 HydrophobicContact CG-CE1 3.91Å; A1192-F1222 HydrophobicContact CB-CD1 4.43Å; A1192-F1222 WeakPolarHBondContact CB-O 3.46Å; A1195-F1222 HydrophobicContact CB-CB 4.33Å; A1195-F1222 HydrophobicContact CB-CD1 4.03Å; A1195-F1222 HydrophobicContact CB-CD2 3.95Å; A1195-F1222 HydrophobicContact CB-CE1 4.32Å; A1195-F1222 HydrophobicContact CB-CE2 4.25Å; A1195-F1222 HydrophobicContact CB-CG 3.84Å; A1195-F1222 HydrophobicContact CB-CZ 4.43Å; L1199-F1222 HydrophobicContact CD1-CD2 3.63Å; L1199-F1222 HydrophobicContact CD1-CE2 3.86Å; F1218-F1222 HydrophobicContact CD1-CE2 4.43Å; F1218-F1222 VanDerWaalsContact O-CD2 3.22Å; F1218-F1222 WeakPolarHBondContact O-CD2 3.08Å; F1218-F1222 PolarHBondContact O-N 3.19Å; K1220-F1222 PolarHBondContact O-N 3.06Å; F1222-R1225 PolarHBondContact O-N 3.14Å; F1222-A1226 PolarHBondContact O-N 2.73Å
1223	Q	92.9	Very high	91.7	Very high	33 Å²	33	42.5 Å²	42.5	15%	0.154	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-42.4	175.9	-173.6	179.3	-26.7	0	0	112.1	A1219 K1220 A1226 E1227	A1219-Q1223 PolarHBondContact O-N 3.23Å; A1219-Q1223 VanDerWaalsContact O-N 3.15Å; K1220-Q1223 WeakPolarHBondContact O-CB 3.48Å; K1220-Q1223 PolarHBondContact O-N 3.11Å; K1220-Q1223 VanDerWaalsContact O-N 3.12Å; Q1223-A1226 WeakPolarHBondContact O-CB 3.49Å; Q1223-A1226 PolarHBondContact O-N 3.19Å; Q1223-E1227 PolarHBondContact O-N 3.42Å
1224	E	91.5	Very high	91.9	Very high	75 Å²	75	39.3 Å²	39.3	35%	0.35	19%	0.189	S	C	.	.	H	α-helix	trans	-66.8	-35.7	177.1	-72	175.5	-178.1	0	0	112	K1220 N1221 E1227 G1228	K1220-E1224 WeakPolarHBondContact CE-OE1 3.08Å; K1220-E1224 PolarHBondContact O-N 3.11Å; N1221-E1224 PolarHBondContact O-N 3.25Å; E1224-E1227 PolarHBondContact O-N 2.98Å; E1224-G1228 PolarHBondContact O-N 3.48Å
1225	R	91.5	Very high	92.1	Very high	54 Å²	54	43.4 Å²	43.4	20%	0.204	20%	0.2	C	C	.	.	H	α-helix	trans	-63.3	-41.7	171	-76.9	173.3	178	154.1	7.3	112.6	E1179 W1182 N1221 F1222 E1227 G1228 V1229	E1179-R1225 VanDerWaalsContact CD-NH2 3.27Å; E1179-R1225 IonicContact OE1-CZ 3.75Å; E1179-R1225 VanDerWaalsContact OE1-CZ 3.22Å; E1179-R1225 IonicContact OE1-NH1 3.15Å; E1179-R1225 PolarHBondContact OE1-NH1 3.46Å; E1179-R1225 IonicContact OE1-NH2 2.85Å; E1179-R1225 PolarHBondContact OE1-NH2 3.03Å; E1179-R1225 IonicContact OE2-NH2 3.29Å; W1182-R1225 HydrophobicContact CH2-CB 3.64Å; W1182-R1225 HydrophobicContact CH2-CG 3.94Å; W1182-R1225 HydrophobicContact CZ2-CB 3.77Å; W1182-R1225 HydrophobicContact CZ2-CG 4.48Å; W1182-R1225 HydrophobicContact CZ3-CB 4.24Å; W1182-R1225 HydrophobicContact CZ3-CG 4.07Å; N1221-R1225 WeakPolarHBondContact O-CG 3.4Å; N1221-R1225 PolarHBondContact O-N 2.94Å; F1222-R1225 PolarHBondContact O-N 3.14Å; R1225-E1227 VanDerWaalsContact C-N 3.33Å; R1225-G1228 PolarHBondContact O-N 3.26Å; R1225-V1229 WeakPolarHBondContact O-CG2 3.46Å; R1225-V1229 PolarHBondContact O-N 2.9Å
1226	A	93.7	Very high	92	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-42.3	175.4	0	0	0	0	0	111.6	I1189 A1192 L1193 F1222 Q1223 L1230 F1269	I1189-A1226 HydrophobicContact CG2-CB 4.46Å; A1192-A1226 HydrophobicContact CB-CB 3.74Å; L1193-A1226 HydrophobicContact CD2-CB 4.11Å; L1193-A1226 HydrophobicContact CG-CB 4.12Å; F1222-A1226 PolarHBondContact O-N 2.73Å; Q1223-A1226 WeakPolarHBondContact O-CB 3.49Å; Q1223-A1226 PolarHBondContact O-N 3.19Å; A1226-L1230 VanDerWaalsContact O-CB 3.29Å; A1226-L1230 WeakPolarHBondContact O-CB 3.46Å; A1226-L1230 PolarHBondContact O-N 2.99Å; A1226-L1230 VanDerWaalsContact O-N 3.08Å; A1226-F1269 HydrophobicContact CB-CD2 4.03Å; A1226-F1269 HydrophobicContact CB-CE2 3.98Å
1227	E	92.1	Very high	92	Very high	67 Å²	67	45.8 Å²	45.8	31%	0.313	22%	0.218	S	C	.	.	H	α-helix	trans	-64.3	-43.7	175.3	-174.8	-179.9	161.2	0	0	111.9	Q1223 E1224 R1225 L1230 N1231	Q1223-E1227 PolarHBondContact O-N 3.42Å; E1224-E1227 PolarHBondContact O-N 2.98Å; R1225-E1227 VanDerWaalsContact C-N 3.33Å; E1227-L1230 PolarHBondContact O-N 3.24Å; E1227-N1231 WeakPolarHBondContact O-CB 3.32Å; E1227-N1231 PolarHBondContact O-N 3.02Å
1228	G	90.9	Very high	91.9	Very high	15 Å²	15	49 Å²	49	16%	0.155	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-46.5	178.8	0	0	0	0	0	113.6	E1224 R1225 L1230 N1231 E1232	E1224-G1228 PolarHBondContact O-N 3.48Å; R1225-G1228 PolarHBondContact O-N 3.26Å; G1228-L1230 VanDerWaalsContact C-N 3.32Å; G1228-L1230 PolarHBondContact O-N 3.08Å; G1228-N1231 PolarHBondContact O-N 3.45Å; G1228-E1232 PolarHBondContact O-N 3.24Å; G1228-E1232 VanDerWaalsContact O-N 3.14Å
1229	V	92.4	Very high	91.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-38	175.4	176.6	0	0	0	0	111	W1182 P1188 I1189 R1225 E1232 C1233 A1740 Y1743	W1182-V1229 HydrophobicContact CH2-CG2 4.08Å; W1182-V1229 HydrophobicContact CZ2-CG2 4.17Å; P1188-V1229 HydrophobicContact CG-CG1 4.35Å; I1189-V1229 HydrophobicContact CD1-CG1 4.09Å; I1189-V1229 HydrophobicContact CG1-CB 4.1Å; I1189-V1229 HydrophobicContact CG1-CG1 3.67Å; R1225-V1229 WeakPolarHBondContact O-CG2 3.46Å; R1225-V1229 PolarHBondContact O-N 2.9Å; V1229-E1232 PolarHBondContact O-N 3.38Å; V1229-C1233 PolarHBondContact O-N 3.46Å; V1229-C1233 PolarHBondContact O-SG 3.11Å; V1229-A1740 HydrophobicContact CG1-CB 3.76Å; V1229-A1740 HydrophobicContact CG2-CB 3.92Å; V1229-Y1743 HydrophobicContact CG2-CD1 3.73Å; V1229-Y1743 HydrophobicContact CG2-CE1 4.3Å; V1229-Y1743 HydrophobicContact CG2-CG 4.18Å
1230	L	93.5	Very high	91.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.6	-42.1	176.8	175.3	62	0	0	0	111.9	I1189 A1226 E1227 G1228 E1232 C1233 Y1234 T1241 I1245 F1269 H1272 C1274	I1189-L1230 HydrophobicContact CD1-CB 4.46Å; A1226-L1230 VanDerWaalsContact O-CB 3.29Å; A1226-L1230 WeakPolarHBondContact O-CB 3.46Å; A1226-L1230 PolarHBondContact O-N 2.99Å; A1226-L1230 VanDerWaalsContact O-N 3.08Å; E1227-L1230 PolarHBondContact O-N 3.24Å; G1228-L1230 VanDerWaalsContact C-N 3.32Å; G1228-L1230 PolarHBondContact O-N 3.08Å; L1230-E1232 VanDerWaalsContact C-N 3.32Å; L1230-E1232 PolarHBondContact O-N 3.13Å; L1230-C1233 PolarHBondContact O-N 3.3Å; L1230-Y1234 VanDerWaalsContact O-CB 3.27Å; L1230-Y1234 WeakPolarHBondContact O-CB 3.21Å; L1230-Y1234 PolarHBondContact O-N 3.42Å; L1230-T1241 HydrophobicContact CD1-CG2 3.44Å; L1230-T1241 VanDerWaalsContact CD1-CG2 3.44Å; L1230-I1245 HydrophobicContact CD1-CD1 3.58Å; L1230-I1245 HydrophobicContact CD1-CG1 4.05Å; L1230-I1245 HydrophobicContact CD2-CD1 4.3Å; L1230-F1269 HydrophobicContact CB-CE2 4.11Å; L1230-F1269 HydrophobicContact CD2-CD2 4.28Å; L1230-F1269 HydrophobicContact CD2-CE1 4.21Å; L1230-F1269 HydrophobicContact CD2-CE2 3.66Å; L1230-F1269 HydrophobicContact CD2-CZ 3.63Å; L1230-F1269 HydrophobicContact CG-CE2 4.47Å; L1230-H1272 HydrophobicContact CD2-CB 3.99Å; L1230-C1274 HydrophobicContact CD1-CB 4.26Å
1231	N	92.3	Very high	91.4	Very high	90 Å²	90	51 Å²	51	48%	0.481	24%	0.236	S	C	.	.	H	α-helix	trans	-61.9	-41.2	177.4	-169	24	0	0	0	111.2	E1227 G1228 Y1234 R1235	E1227-N1231 WeakPolarHBondContact O-CB 3.32Å; E1227-N1231 PolarHBondContact O-N 3.02Å; G1228-N1231 PolarHBondContact O-N 3.45Å; N1231-Y1234 PolarHBondContact O-N 2.9Å; N1231-R1235 WeakPolarHBondContact O-CB 3.28Å; N1231-R1235 PolarHBondContact O-N 3.07Å
1232	E	90.4	Very high	91.2	Very high	13 Å²	13	49 Å²	49	6%	0.061	23%	0.225	C	C	.	.	H	α-helix	trans	-66.9	-41.3	177.2	-167.4	56.3	-150.2	0	0	112.5	G1228 V1229 L1230 Y1234 R1235 E1236 K1739	G1228-E1232 PolarHBondContact O-N 3.24Å; G1228-E1232 VanDerWaalsContact O-N 3.14Å; V1229-E1232 PolarHBondContact O-N 3.38Å; L1230-E1232 VanDerWaalsContact C-N 3.32Å; L1230-E1232 PolarHBondContact O-N 3.13Å; E1232-Y1234 VanDerWaalsContact C-N 3.33Å; E1232-R1235 VanDerWaalsContact CD-NH2 3.26Å; E1232-R1235 IonicContact OE1-CZ 3.29Å; E1232-R1235 IonicContact OE1-NE 3.59Å; E1232-R1235 IonicContact OE1-NH2 2.67Å; E1232-R1235 PolarHBondContact OE1-NH2 3.11Å; E1232-R1235 IonicContact OE2-CZ 3.86Å; E1232-R1235 IonicContact OE2-NE 3.24Å; E1232-R1235 PolarHBondContact OE2-NE 3.04Å; E1232-R1235 IonicContact OE2-NH2 3.39Å; E1232-R1235 PolarHBondContact OE2-NH2 3.14Å; E1232-E1236 PolarHBondContact O-N 2.92Å; E1232-K1739 HydrophobicContact CG-CD 4.39Å
1233	C	91.9	Very high	90.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-43.8	172.8	-64.9	0	0	0	0	111.2	V1229 L1230 E1236 D1237 T1241 W1735	V1229-C1233 PolarHBondContact O-N 3.46Å; V1229-C1233 PolarHBondContact O-SG 3.11Å; L1230-C1233 PolarHBondContact O-N 3.3Å; C1233-E1236 PolarHBondContact O-N 2.7Å; C1233-D1237 PolarHBondContact O-N 3.17Å; C1233-T1241 HydrophobicContact CB-CG2 3.85Å; C1233-T1241 WeakPolarHBondContact CB-OG1 3.46Å; C1233-T1241 PolarHBondContact O-OG1 2.8Å; C1233-W1735 HydrophobicContact CB-CH2 4.12Å; C1233-W1735 HydrophobicContact CB-CZ3 4.2Å
1234	Y	92.6	Very high	90.7	Very high	31 Å²	31	50.5 Å²	50.5	12%	0.122	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-38.4	-177.1	-170.7	-117.7	0	0	0	112.8	L1230 N1231 E1232 E1236 E1238 T1241 P1273 C1274 D1277	L1230-Y1234 VanDerWaalsContact O-CB 3.27Å; L1230-Y1234 WeakPolarHBondContact O-CB 3.21Å; L1230-Y1234 PolarHBondContact O-N 3.42Å; N1231-Y1234 PolarHBondContact O-N 2.9Å; E1232-Y1234 VanDerWaalsContact C-N 3.33Å; Y1234-E1236 PolarHBondContact O-N 2.76Å; Y1234-E1238 HydrophobicContact CD2-CB 4.21Å; Y1234-E1238 HydrophobicContact CD2-CG 4.12Å; Y1234-E1238 HydrophobicContact CE2-CB 3.72Å; Y1234-E1238 HydrophobicContact CE2-CG 3.59Å; Y1234-T1241 PolarHBondContact N-OG1 3.27Å; Y1234-P1273 HydrophobicContact CE1-CB 4.05Å; Y1234-C1274 HydrophobicContact CD1-CB 4.38Å; Y1234-C1274 HydrophobicContact CD2-CB 3.38Å; Y1234-C1274 WeakPolarHBondContact CD2-SG 3.21Å; Y1234-C1274 HydrophobicContact CE2-CB 3.75Å; Y1234-C1274 HydrophobicContact CG-CB 3.75Å; Y1234-D1277 PolarHBondContact OH-OD2 2.73Å
1235	R	90.6	Very high	90.7	Very high	151 Å²	151	47 Å²	47	57%	0.57	22%	0.217	S	C	*	.	H	α-helix	trans	-61.8	-31.4	176.8	-174.6	173.5	72.3	158	-5.9	112.8	N1231 E1232 E1746	N1231-R1235 WeakPolarHBondContact O-CB 3.28Å; N1231-R1235 PolarHBondContact O-N 3.07Å; E1232-R1235 VanDerWaalsContact CD-NH2 3.26Å; E1232-R1235 IonicContact OE1-CZ 3.29Å; E1232-R1235 IonicContact OE1-NE 3.59Å; E1232-R1235 IonicContact OE1-NH2 2.67Å; E1232-R1235 PolarHBondContact OE1-NH2 3.11Å; E1232-R1235 IonicContact OE2-CZ 3.86Å; E1232-R1235 IonicContact OE2-NE 3.24Å; E1232-R1235 PolarHBondContact OE2-NE 3.04Å; E1232-R1235 IonicContact OE2-NH2 3.39Å; E1232-R1235 PolarHBondContact OE2-NH2 3.14Å; R1235-E1746 IonicContact CZ-OE1 3.88Å; R1235-E1746 IonicContact NH1-OE1 2.78Å; R1235-E1746 IonicContact NH2-OE1 2.75Å; R1235-E1746 PolarHBondContact NH2-OE1 2.99Å
1236	E	89.7	Confident	90.6	Very high	108 Å²	108	45.3 Å²	45.3	51%	0.505	21%	0.212	S	C	.	.	H	α-helix	trans	-90	-48.2	-175.7	-73.9	-89.8	-157.1	0	0	113	E1232 C1233 Y1234 W1735 K1739	E1232-E1236 PolarHBondContact O-N 2.92Å; C1233-E1236 PolarHBondContact O-N 2.7Å; Y1234-E1236 PolarHBondContact O-N 2.76Å; E1236-W1735 HydrophobicContact CB-CZ2 4.2Å; E1236-K1739 HydrophobicContact CB-CD 4.4Å; E1236-K1739 VanDerWaalsContact CD-NZ 3.26Å; E1236-K1739 HydrophobicContact CG-CD 3.93Å; E1236-K1739 IonicContact OE1-NZ 3.38Å; E1236-K1739 PolarHBondContact OE1-NZ 3.35Å; E1236-K1739 IonicContact OE2-NZ 2.66Å
1237	D	90.8	Very high	90.2	Very high	62 Å²	62	45.8 Å²	45.8	33%	0.332	21%	0.214	S	C	.	.			trans	-150	103.8	178.2	-174.3	-23.6	0	0	0	110.9	C1233 H1239 R1240 T1241 W1735	C1233-D1237 PolarHBondContact O-N 3.17Å; D1237-H1239 PolarHBondContact O-N 3.09Å; D1237-H1239 PolarHBondContact OD1-N 3.47Å; D1237-R1240 HydrophobicContact CB-CB 3.94Å; D1237-R1240 PolarHBondContact OD1-N 3.36Å; D1237-R1240 VanDerWaalsContact OD2-CB 3.29Å; D1237-R1240 WeakPolarHBondContact OD2-CB 3.35Å; D1237-T1241 VanDerWaalsContact O-CB 3.31Å; D1237-T1241 WeakPolarHBondContact O-CB 3.45Å; D1237-T1241 PolarHBondContact O-N 3.22Å; D1237-T1241 PolarHBondContact O-OG1 3.15Å; D1237-W1735 HydrophobicContact CB-CH2 3.97Å; D1237-W1735 HydrophobicContact CB-CZ2 3.81Å
1238	E	89.4	Confident	89.9	Confident	112 Å²	112	44.3 Å²	44.3	52%	0.523	21%	0.208	S	C	.	.	H	α-helix	trans	-59.3	-44.1	179	-59.6	-178.1	178.2	0	0	112.2	Y1234 T1241 Q1242	Y1234-E1238 HydrophobicContact CD2-CB 4.21Å; Y1234-E1238 HydrophobicContact CD2-CG 4.12Å; Y1234-E1238 HydrophobicContact CE2-CB 3.72Å; Y1234-E1238 HydrophobicContact CE2-CG 3.59Å; E1238-T1241 PolarHBondContact O-N 2.8Å; E1238-Q1242 WeakPolarHBondContact O-CG 3.3Å; E1238-Q1242 PolarHBondContact O-N 3.04Å
1239	H	86.9	Confident	89.6	Confident	129 Å²	129	43.8 Å²	43.8	60%	0.597	20%	0.201	S	C	*	.	H	α-helix	trans	-70.4	-47.1	-173.9	178	-91.5	0	0	0	110.6	D1237 T1241 Q1242 L1243	D1237-H1239 PolarHBondContact O-N 3.09Å; D1237-H1239 PolarHBondContact OD1-N 3.47Å; H1239-T1241 VanDerWaalsContact C-N 3.29Å; H1239-T1241 PolarHBondContact O-N 2.97Å; H1239-Q1242 PolarHBondContact O-N 3.48Å; H1239-L1243 VanDerWaalsContact CE1-CD1 3.42Å; H1239-L1243 WeakPolarHBondContact CE1-CD1 3.47Å; H1239-L1243 WeakPolarHBondContact O-CD1 3.39Å; H1239-L1243 PolarHBondContact O-N 3.13Å
1240	R	88.7	Confident	89.1	Confident	68 Å²	68	46.6 Å²	46.6	26%	0.257	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-36.8	177	-169.8	176	-175	167.5	5.6	111.8	D1237 L1243 I1244 E1731 M1732 W1735	D1237-R1240 HydrophobicContact CB-CB 3.94Å; D1237-R1240 PolarHBondContact OD1-N 3.36Å; D1237-R1240 VanDerWaalsContact OD2-CB 3.29Å; D1237-R1240 WeakPolarHBondContact OD2-CB 3.35Å; R1240-L1243 WeakPolarHBondContact O-CB 3.23Å; R1240-L1243 PolarHBondContact O-N 3.02Å; R1240-I1244 WeakPolarHBondContact O-CG1 3.45Å; R1240-I1244 PolarHBondContact O-N 3.08Å; R1240-I1244 VanDerWaalsContact O-N 3.16Å; R1240-E1731 PolarHBondContact NH2-O 3.38Å; R1240-M1732 HydrophobicContact CG-CG 4.37Å; R1240-W1735 HydrophobicContact CB-CH2 4.03Å; R1240-W1735 HydrophobicContact CB-CZ3 4.02Å; R1240-W1735 VanDerWaalsContact CD-CE3 3.47Å; R1240-W1735 HydrophobicContact CG-CD2 4.34Å; R1240-W1735 HydrophobicContact CG-CE3 3.79Å; R1240-W1735 HydrophobicContact CG-CH2 4.06Å; R1240-W1735 HydrophobicContact CG-CZ3 3.62Å
1241	T	91.4	Very high	88.7	Confident	1 Å²	1	49 Å²	49	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-41.9	176	-56.2	0	0	0	0	112.1	L1230 C1233 Y1234 D1237 E1238 H1239 L1243 I1244 I1245 C1274	L1230-T1241 HydrophobicContact CD1-CG2 3.44Å; L1230-T1241 VanDerWaalsContact CD1-CG2 3.44Å; C1233-T1241 HydrophobicContact CB-CG2 3.85Å; C1233-T1241 WeakPolarHBondContact CB-OG1 3.46Å; C1233-T1241 PolarHBondContact O-OG1 2.8Å; Y1234-T1241 PolarHBondContact N-OG1 3.27Å; D1237-T1241 VanDerWaalsContact O-CB 3.31Å; D1237-T1241 WeakPolarHBondContact O-CB 3.45Å; D1237-T1241 PolarHBondContact O-N 3.22Å; D1237-T1241 PolarHBondContact O-OG1 3.15Å; E1238-T1241 PolarHBondContact O-N 2.8Å; H1239-T1241 VanDerWaalsContact C-N 3.29Å; H1239-T1241 PolarHBondContact O-N 2.97Å; T1241-L1243 PolarHBondContact O-N 3.28Å; T1241-I1244 PolarHBondContact O-N 2.91Å; T1241-I1245 HydrophobicContact CG2-CD1 4.39Å; T1241-I1245 WeakPolarHBondContact O-CG1 3.4Å; T1241-I1245 PolarHBondContact O-N 2.99Å; T1241-I1245 VanDerWaalsContact O-N 3.14Å; T1241-C1274 WeakPolarHBondContact CG2-SG 3.39Å
1242	Q	89.1	Confident	88.4	Confident	21 Å²	21	44.7 Å²	44.7	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-60.6	-33.8	174.1	-71.3	-179.3	22.9	0	0	112.4	E1238 H1239 N1246 F1278 N1281	E1238-Q1242 WeakPolarHBondContact O-CG 3.3Å; E1238-Q1242 PolarHBondContact O-N 3.04Å; H1239-Q1242 PolarHBondContact O-N 3.48Å; Q1242-N1246 PolarHBondContact O-N 3.11Å; Q1242-N1246 PolarHBondContact O-OD1 2.9Å; Q1242-F1278 HydrophobicContact CB-CD2 4.25Å; Q1242-F1278 HydrophobicContact CG-CB 4.13Å; Q1242-N1281 PolarHBondContact OE1-ND2 2.83Å
1243	L	86.7	Confident	87.8	Confident	55 Å²	55	44.2 Å²	44.2	29%	0.288	20%	0.201	S	C	.	.	H	α-helix	trans	-69.2	-31.5	173.9	-90.3	78.4	0	0	0	113.2	H1239 R1240 T1241 N1246 H1247 F1723 M1732	H1239-L1243 VanDerWaalsContact CE1-CD1 3.42Å; H1239-L1243 WeakPolarHBondContact CE1-CD1 3.47Å; H1239-L1243 WeakPolarHBondContact O-CD1 3.39Å; H1239-L1243 PolarHBondContact O-N 3.13Å; R1240-L1243 WeakPolarHBondContact O-CB 3.23Å; R1240-L1243 PolarHBondContact O-N 3.02Å; T1241-L1243 PolarHBondContact O-N 3.28Å; L1243-N1246 WeakPolarHBondContact CA-OD1 3.3Å; L1243-N1246 PolarHBondContact O-OD1 3.16Å; L1243-H1247 WeakPolarHBondContact O-CB 3.38Å; L1243-H1247 PolarHBondContact O-N 3.42Å; L1243-F1723 HydrophobicContact CB-CZ 4.42Å; L1243-F1723 HydrophobicContact CD2-CE1 4.18Å; L1243-M1732 HydrophobicContact CB-SD 4.17Å; L1243-M1732 HydrophobicContact CD2-SD 4.21Å
1244	I	89.2	Confident	87.3	Confident	9 Å²	9	50 Å²	50	5%	0.046	22%	0.223	C	C	.	.	H	α-helix	trans	-71.3	-42.7	177.6	-69	169.2	0	0	0	110.4	R1240 T1241 N1246 H1247 W1735 E1736	R1240-I1244 WeakPolarHBondContact O-CG1 3.45Å; R1240-I1244 PolarHBondContact O-N 3.08Å; R1240-I1244 VanDerWaalsContact O-N 3.16Å; T1241-I1244 PolarHBondContact O-N 2.91Å; I1244-N1246 VanDerWaalsContact C-N 3.33Å; I1244-N1246 PolarHBondContact O-N 3.17Å; I1244-H1247 WeakPolarHBondContact O-CB 3.43Å; I1244-H1247 PolarHBondContact O-N 3.38Å; I1244-W1735 HydrophobicContact CD1-CE3 3.55Å; I1244-W1735 HydrophobicContact CD1-CZ3 3.43Å; I1244-W1735 VanDerWaalsContact CD1-CZ3 3.43Å; I1244-E1736 HydrophobicContact CD1-CB 4.18Å
1245	I	91.1	Very high	86.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-34.9	-174.9	-68.9	174.6	0	0	0	112.7	L1230 T1241 V1257 I1258 C1274	L1230-I1245 HydrophobicContact CD1-CD1 3.58Å; L1230-I1245 HydrophobicContact CD1-CG1 4.05Å; L1230-I1245 HydrophobicContact CD2-CD1 4.3Å; T1241-I1245 HydrophobicContact CG2-CD1 4.39Å; T1241-I1245 WeakPolarHBondContact O-CG1 3.4Å; T1241-I1245 PolarHBondContact O-N 2.99Å; T1241-I1245 VanDerWaalsContact O-N 3.14Å; I1245-V1257 PolarHBondContact O-N 3.39Å; I1245-I1258 HydrophobicContact CG2-CB 3.57Å; I1245-I1258 HydrophobicContact CG2-CD1 4.42Å; I1245-I1258 HydrophobicContact CG2-CG1 4.37Å; I1245-I1258 HydrophobicContact CG2-CG2 4.27Å; I1245-I1258 PolarHBondContact O-N 3.3Å; I1245-I1258 VanDerWaalsContact O-N 3.15Å; I1245-C1274 HydrophobicContact CD1-CB 4.15Å; I1245-C1274 WeakPolarHBondContact CD1-SG 3.41Å
1246	N	88.7	Confident	86.7	Confident	20 Å²	20	41.4 Å²	41.4	11%	0.107	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	0.3	-179.1	76.8	-8.7	0	0	0	114.1	Q1242 L1243 I1244 F1278 P1718 C1720 V1721	Q1242-N1246 PolarHBondContact O-N 3.11Å; Q1242-N1246 PolarHBondContact O-OD1 2.9Å; L1243-N1246 WeakPolarHBondContact CA-OD1 3.3Å; L1243-N1246 PolarHBondContact O-OD1 3.16Å; I1244-N1246 VanDerWaalsContact C-N 3.33Å; I1244-N1246 PolarHBondContact O-N 3.17Å; N1246-F1278 HydrophobicContact CB-CE1 4.41Å; N1246-F1278 HydrophobicContact CB-CE2 3.78Å; N1246-F1278 HydrophobicContact CB-CZ 3.6Å; N1246-F1278 WeakPolarHBondContact ND2-CE2 3.39Å; N1246-P1718 PolarHBondContact ND2-O 3Å; N1246-C1720 CarbonylContact O-C 3.54Å; N1246-C1720 VanDerWaalsContact O-CA 3.25Å; N1246-C1720 WeakPolarHBondContact O-CA 3.49Å; N1246-V1721 PolarHBondContact O-N 2.96Å
1247	H	85.8	Confident	86.8	Confident	9 Å²	9	36.4 Å²	36.4	4%	0.042	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-67.2	144.2	178.4	172.9	-122	0	0	0	112.5	L1243 I1244 L1249 S1256 V1721 F1723 E1729	L1243-H1247 WeakPolarHBondContact O-CB 3.38Å; L1243-H1247 PolarHBondContact O-N 3.42Å; I1244-H1247 WeakPolarHBondContact O-CB 3.43Å; I1244-H1247 PolarHBondContact O-N 3.38Å; H1247-L1249 PolarHBondContact O-N 3.4Å; H1247-S1256 VanDerWaalsContact O-CA 3.23Å; H1247-S1256 WeakPolarHBondContact O-CA 3.4Å; H1247-S1256 VanDerWaalsContact O-CB 3.28Å; H1247-S1256 WeakPolarHBondContact O-CB 3.23Å; H1247-V1721 WeakPolarHBondContact CA-O 3.22Å; H1247-F1723 HydrophobicContact CB-CE2 3.72Å; H1247-F1723 HydrophobicContact CB-CZ 4.05Å; H1247-F1723 AromaticContact CD2-CD2 3Å; H1247-F1723 WeakPolarHBondContact CD2-CD2 3.37Å; H1247-F1723 AromaticContact CD2-CE2 3Å; H1247-F1723 WeakPolarHBondContact CD2-CE2 3.34Å; H1247-F1723 AromaticContact CD2-CG 3.9Å; H1247-F1723 AromaticContact CD2-CZ 3.89Å; H1247-F1723 AromaticContact CE1-CD2 3.95Å; H1247-F1723 AromaticContact CG-CD2 3.76Å; H1247-F1723 AromaticContact CG-CE2 3.27Å; H1247-F1723 AromaticContact ND1-CE2 3.94Å; H1247-F1723 AromaticContact NE2-CD2 3.15Å; H1247-F1723 WeakPolarHBondContact NE2-CD2 3.48Å; H1247-F1723 AromaticContact NE2-CE2 3.56Å; H1247-E1729 IonicContact CE1-OE1 2.9Å; H1247-E1729 IonicContact NE2-OE1 2.73Å
1248	E	85	Confident	86.8	Confident	37 Å²	37	33.4 Å²	33.4	17%	0.173	15%	0.151	C	C	.	.			trans	-74.4	112	171.6	-173.7	-174.7	168	0	0	112	I1250 R1254 V1721	E1248-I1250 PolarHBondContact O-N 2.76Å; E1248-R1254 HydrophobicContact CG-CB 4.27Å; E1248-R1254 WeakPolarHBondContact OE1-CB 3.29Å; E1248-V1721 PolarHBondContact N-O 3.26Å
1249	L	85.6	Confident	86.8	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.016	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-85.8	104.2	178.9	-58.8	161.1	0	0	0	111.1	E1187 A1190 H1247 Y1251 Y1252 R1254 S1255 V1257 L1260	E1187-L1249 HydrophobicContact CG-CD2 4.46Å; A1190-L1249 HydrophobicContact CB-CD1 3.52Å; A1190-L1249 HydrophobicContact CB-CD2 4.21Å; A1190-L1249 HydrophobicContact CB-CG 4.48Å; H1247-L1249 PolarHBondContact O-N 3.4Å; L1249-Y1251 VanDerWaalsContact C-N 3.31Å; L1249-Y1251 PolarHBondContact O-N 2.92Å; L1249-Y1252 HydrophobicContact CB-CD2 4.12Å; L1249-Y1252 HydrophobicContact CB-CG 4.43Å; L1249-Y1252 HydrophobicContact CD1-CD2 4.46Å; L1249-Y1252 HydrophobicContact CD1-CG 4.49Å; L1249-Y1252 PolarHBondContact O-N 2.97Å; L1249-R1254 VanDerWaalsContact O-CA 3.28Å; L1249-R1254 WeakPolarHBondContact O-CA 3.43Å; L1249-R1254 PolarHBondContact O-N 2.87Å; L1249-S1255 VanDerWaalsContact CB-O 3.26Å; L1249-S1255 WeakPolarHBondContact CB-O 3.25Å; L1249-S1255 PolarHBondContact N-O 3.28Å; L1249-V1257 HydrophobicContact CD1-CG2 3.8Å; L1249-L1260 HydrophobicContact CD1-CD1 3.78Å
1250	I	82.5	Confident	86.9	Confident	60 Å²	60	24.7 Å²	24.7	31%	0.308	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-39.3	-177	-59.2	172.6	0	0	0	111.9	E1248	E1248-I1250 PolarHBondContact O-N 2.76Å
1251	Y	83.8	Confident	87	Confident	49 Å²	49	21.4 Å²	21.4	19%	0.192	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-18.1	-176.8	-63.2	-79	0	0	0	114	L663 D1159 R1160 R1163 L1249	L663-Y1251 HydrophobicContact CD2-CD1 4.21Å; D1159-Y1251 HydrophobicContact CB-CE1 3.92Å; D1159-Y1251 WeakPolarHBondContact CB-OH 3.42Å; R1160-Y1251 HydrophobicContact CG-CD1 4.3Å; R1160-Y1251 HydrophobicContact CG-CD2 4.43Å; R1160-Y1251 HydrophobicContact CG-CE1 4.11Å; R1160-Y1251 HydrophobicContact CG-CE2 4.25Å; R1160-Y1251 HydrophobicContact CG-CG 4.45Å; R1160-Y1251 VanDerWaalsContact NE-CE2 3.28Å; R1163-Y1251 PolarHBondContact NE-O 3.04Å; L1249-Y1251 VanDerWaalsContact C-N 3.31Å; L1249-Y1251 PolarHBondContact O-N 2.92Å
1252	Y	87.5	Confident	86.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	47.4	-179.2	-62.5	-90	0	0	0	111.2	Y660 R1163 E1185 E1187 A1190 A1191 L1194 L1249 R1254	Y660-Y1252 VanDerWaalsContact CE2-O 3.27Å; Y660-Y1252 WeakPolarHBondContact CE2-O 3.42Å; R1163-Y1252 HydrophobicContact CG-CE1 4.46Å; E1185-Y1252 PolarHBondContact OE1-OH 2.97Å; E1185-Y1252 PolarHBondContact OE2-OH 2.86Å; E1187-Y1252 HydrophobicContact CB-CE2 4.15Å; E1187-Y1252 WeakPolarHBondContact OE2-CE2 3.43Å; A1190-Y1252 HydrophobicContact CB-CD1 4.07Å; A1190-Y1252 HydrophobicContact CB-CD2 3.71Å; A1190-Y1252 HydrophobicContact CB-CE1 4.17Å; A1190-Y1252 HydrophobicContact CB-CE2 3.81Å; A1190-Y1252 HydrophobicContact CB-CG 3.87Å; A1191-Y1252 HydrophobicContact CB-CE1 4.33Å; A1191-Y1252 VanDerWaalsContact CB-OH 3.31Å; A1191-Y1252 WeakPolarHBondContact CB-OH 3.48Å; L1194-Y1252 HydrophobicContact CB-CD1 4.09Å; L1194-Y1252 HydrophobicContact CB-CE1 4.23Å; L1194-Y1252 HydrophobicContact CD2-CD1 3.77Å; L1194-Y1252 HydrophobicContact CD2-CE1 3.92Å; L1194-Y1252 HydrophobicContact CG-CD1 4.5Å; L1249-Y1252 HydrophobicContact CB-CD2 4.12Å; L1249-Y1252 HydrophobicContact CB-CG 4.43Å; L1249-Y1252 HydrophobicContact CD1-CD2 4.46Å; L1249-Y1252 HydrophobicContact CD1-CG 4.49Å; L1249-Y1252 PolarHBondContact O-N 2.97Å; Y1252-R1254 PolarHBondContact O-N 3.36Å
1253	G	76.5	Confident	86.5	Confident	4 Å²	4	23.8 Å²	23.8	4%	0.041	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	22.6	170.6	0	0	0	0	0	116.4	H661 S1255	H661-G1253 VanDerWaalsContact O-CA 3.24Å; H661-G1253 WeakPolarHBondContact O-CA 3.46Å; G1253-S1255 PolarHBondContact O-N 3.49Å
1254	R	82	Confident	86.3	Confident	120 Å²	120	22.2 Å²	22.2	45%	0.453	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	33.8	-175.5	-60.4	-175.4	-178.1	177.4	-4.4	112.5	E668 E1248 L1249 Y1252	E668-R1254 IonicContact OE1-CZ 3.7Å; E668-R1254 IonicContact OE1-NH2 3.33Å; E668-R1254 PolarHBondContact OE1-NH2 2.81Å; E668-R1254 IonicContact OE2-NH2 2.76Å; E668-R1254 PolarHBondContact OE2-NH2 3.15Å; E1248-R1254 HydrophobicContact CG-CB 4.27Å; E1248-R1254 WeakPolarHBondContact OE1-CB 3.29Å; L1249-R1254 VanDerWaalsContact O-CA 3.28Å; L1249-R1254 WeakPolarHBondContact O-CA 3.43Å; L1249-R1254 PolarHBondContact O-N 2.87Å; Y1252-R1254 PolarHBondContact O-N 3.36Å
1255	S	82.9	Confident	86	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.021	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-102.2	165.6	173.2	-168.7	0	0	0	0	109.5	L1249 G1253	L1249-S1255 VanDerWaalsContact CB-O 3.26Å; L1249-S1255 WeakPolarHBondContact CB-O 3.25Å; L1249-S1255 PolarHBondContact N-O 3.28Å; G1253-S1255 PolarHBondContact O-N 3.49Å
1256	S	88.1	Confident	85.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.126	C	C	.	.			trans	-98.4	160.8	168	58.8	0	0	0	0	111.1	H1247 I1258 K1259 L1260 F1719	H1247-S1256 VanDerWaalsContact O-CA 3.23Å; H1247-S1256 WeakPolarHBondContact O-CA 3.4Å; H1247-S1256 VanDerWaalsContact O-CB 3.28Å; H1247-S1256 WeakPolarHBondContact O-CB 3.23Å; S1256-I1258 VanDerWaalsContact C-N 3.3Å; S1256-I1258 PolarHBondContact O-N 3.5Å; S1256-I1258 WeakPolarHBondContact OG-CG2 3.37Å; S1256-K1259 PolarHBondContact O-N 2.6Å; S1256-K1259 VanDerWaalsContact O-N 3.13Å; S1256-K1259 WeakPolarHBondContact OG-CB 3.21Å; S1256-K1259 PolarHBondContact OG-N 2.89Å; S1256-L1260 WeakPolarHBondContact O-CG 3.39Å; S1256-L1260 PolarHBondContact O-N 2.83Å; S1256-F1719 WeakPolarHBondContact CB-O 3.48Å; S1256-F1719 PolarHBondContact OG-O 3.41Å
1257	V	91.9	Very high	85.8	Confident	2 Å²	2	28 Å²	28	1%	0.012	13%	0.133	C	C	.	.	H	α-helix	trans	-55.8	-46	178.2	179.3	0	0	0	0	110.7	I1189 L1193 I1245 L1249 K1259 L1260 A1261 F1269	I1189-V1257 HydrophobicContact CG2-CG1 3.58Å; L1193-V1257 HydrophobicContact CD1-CG1 3.61Å; I1245-V1257 PolarHBondContact O-N 3.39Å; L1249-V1257 HydrophobicContact CD1-CG2 3.8Å; V1257-K1259 VanDerWaalsContact C-N 3.29Å; V1257-K1259 PolarHBondContact O-N 2.94Å; V1257-L1260 PolarHBondContact O-N 2.84Å; V1257-A1261 WeakPolarHBondContact O-CB 3.06Å; V1257-A1261 PolarHBondContact O-N 2.97Å; V1257-F1269 HydrophobicContact CG1-CE1 3.93Å; V1257-F1269 HydrophobicContact CG1-CZ 3.68Å
1258	I	91.1	Very high	85.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-36.9	179	-166.9	166	0	0	0	112.6	I1245 S1256 A1262 M1270 F1278 L1279 Y1672 F1719	I1245-I1258 HydrophobicContact CG2-CB 3.57Å; I1245-I1258 HydrophobicContact CG2-CD1 4.42Å; I1245-I1258 HydrophobicContact CG2-CG1 4.37Å; I1245-I1258 HydrophobicContact CG2-CG2 4.27Å; I1245-I1258 PolarHBondContact O-N 3.3Å; I1245-I1258 VanDerWaalsContact O-N 3.15Å; S1256-I1258 VanDerWaalsContact C-N 3.3Å; S1256-I1258 PolarHBondContact O-N 3.5Å; S1256-I1258 WeakPolarHBondContact OG-CG2 3.37Å; I1258-A1262 VanDerWaalsContact O-CB 3.3Å; I1258-A1262 WeakPolarHBondContact O-CB 3.29Å; I1258-A1262 PolarHBondContact O-N 3.33Å; I1258-M1270 HydrophobicContact CD1-CE 4.39Å; I1258-M1270 HydrophobicContact CG1-CE 3.95Å; I1258-M1270 HydrophobicContact CG1-SD 4.06Å; I1258-F1278 HydrophobicContact CD1-CD1 3.64Å; I1258-F1278 HydrophobicContact CD1-CE1 3.8Å; I1258-L1279 HydrophobicContact CD1-CD2 4.29Å; I1258-L1279 HydrophobicContact CD1-CG 4.46Å; I1258-Y1672 HydrophobicContact CD1-CD2 4.02Å; I1258-Y1672 HydrophobicContact CD1-CE2 3.99Å; I1258-Y1672 HydrophobicContact CG1-CD2 4.11Å; I1258-Y1672 HydrophobicContact CG1-CE2 3.82Å; I1258-F1719 HydrophobicContact CD1-CD1 4.35Å; I1258-F1719 HydrophobicContact CD1-CE1 4.44Å; I1258-F1719 HydrophobicContact CG2-CD1 4.25Å
1259	K	87.6	Confident	86.2	Confident	57 Å²	57	30.1 Å²	30.1	25%	0.248	14%	0.142	C	C	.	.	H	α-helix	trans	-73.2	-39.9	177.6	-172.5	177.1	-178.1	-174.7	0	111.2	S1256 V1257 A1262 E1263	S1256-K1259 PolarHBondContact O-N 2.6Å; S1256-K1259 VanDerWaalsContact O-N 3.13Å; S1256-K1259 WeakPolarHBondContact OG-CB 3.21Å; S1256-K1259 PolarHBondContact OG-N 2.89Å; V1257-K1259 VanDerWaalsContact C-N 3.29Å; V1257-K1259 PolarHBondContact O-N 2.94Å; K1259-A1262 PolarHBondContact O-N 3.44Å; K1259-E1263 HydrophobicContact CG-CG 4.2Å; K1259-E1263 WeakPolarHBondContact O-CB 3.47Å; K1259-E1263 VanDerWaalsContact O-CG 3.22Å; K1259-E1263 WeakPolarHBondContact O-CG 3.46Å; K1259-E1263 PolarHBondContact O-N 2.76Å
1260	L	89.5	Confident	86.4	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.5	-45.7	173.4	-69.9	175.5	0	0	0	111.1	F659 Y660 L1249 S1256 V1257 G1264	F659-L1260 HydrophobicContact CE2-CD2 3.94Å; Y660-L1260 HydrophobicContact CD2-CD2 4.07Å; Y660-L1260 HydrophobicContact CE2-CD2 4.44Å; L1249-L1260 HydrophobicContact CD1-CD1 3.78Å; S1256-L1260 WeakPolarHBondContact O-CG 3.39Å; S1256-L1260 PolarHBondContact O-N 2.83Å; V1257-L1260 PolarHBondContact O-N 2.84Å; L1260-G1264 WeakPolarHBondContact O-CA 3.12Å; L1260-G1264 PolarHBondContact O-N 2.75Å
1261	A	91.5	Very high	86.7	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.1	-40.2	178.1	0	0	0	0	0	112.8	L1193 V1257 Q1265 S1266 F1269 M1270	L1193-A1261 HydrophobicContact CD1-CB 3.99Å; L1193-A1261 HydrophobicContact CD2-CB 4.29Å; V1257-A1261 WeakPolarHBondContact O-CB 3.06Å; V1257-A1261 PolarHBondContact O-N 2.97Å; A1261-Q1265 PolarHBondContact O-N 3.48Å; A1261-S1266 PolarHBondContact O-N 3.21Å; A1261-F1269 HydrophobicContact CB-CD1 3.4Å; A1261-F1269 VanDerWaalsContact CB-CD1 3.4Å; A1261-F1269 HydrophobicContact CB-CE1 3.83Å; A1261-F1269 HydrophobicContact CB-CG 4.28Å; A1261-M1270 HydrophobicContact CB-CG 4.3Å; A1261-M1270 HydrophobicContact CB-SD 3.85Å
1262	A	86.8	Confident	87.1	Confident	3 Å²	3	26.2 Å²	26.2	3%	0.025	13%	0.127	C	C	.	.	H	α-helix	trans	-69.6	-41.9	-179.5	0	0	0	0	0	113	I1258 K1259 M1270 Y1669 Y1672	I1258-A1262 VanDerWaalsContact O-CB 3.3Å; I1258-A1262 WeakPolarHBondContact O-CB 3.29Å; I1258-A1262 PolarHBondContact O-N 3.33Å; K1259-A1262 PolarHBondContact O-N 3.44Å; A1262-M1270 HydrophobicContact CB-CE 4.34Å; A1262-M1270 HydrophobicContact CB-SD 4.22Å; A1262-Y1669 HydrophobicContact CB-CE2 4.42Å; A1262-Y1669 WeakPolarHBondContact O-CE2 3.3Å; A1262-Y1669 PolarHBondContact O-OH 3.26Å; A1262-Y1672 HydrophobicContact CB-CD1 3.81Å; A1262-Y1672 HydrophobicContact CB-CE1 3.33Å; A1262-Y1672 HydrophobicContact CB-CE2 4.37Å
1263	E	83	Confident	87.3	Confident	69 Å²	69	29.7 Å²	29.7	32%	0.322	15%	0.149	S	C	.	.	H	α-helix	trans	-75.3	-33.5	177	-63	-73	177.7	0	0	111.6	F659 K1259 Q1265	F659-E1263 HydrophobicContact CD1-CB 3.87Å; F659-E1263 HydrophobicContact CD1-CG 3.99Å; F659-E1263 HydrophobicContact CD2-CB 4.1Å; F659-E1263 HydrophobicContact CD2-CG 3.96Å; F659-E1263 HydrophobicContact CE1-CB 3.51Å; F659-E1263 HydrophobicContact CE1-CG 4.15Å; F659-E1263 HydrophobicContact CE2-CB 3.75Å; F659-E1263 HydrophobicContact CE2-CG 4.12Å; F659-E1263 HydrophobicContact CG-CB 4.16Å; F659-E1263 HydrophobicContact CG-CG 3.9Å; F659-E1263 HydrophobicContact CZ-CB 3.44Å; F659-E1263 VanDerWaalsContact CZ-CB 3.44Å; F659-E1263 HydrophobicContact CZ-CG 4.21Å; K1259-E1263 HydrophobicContact CG-CG 4.2Å; K1259-E1263 WeakPolarHBondContact O-CB 3.47Å; K1259-E1263 VanDerWaalsContact O-CG 3.22Å; K1259-E1263 WeakPolarHBondContact O-CG 3.46Å; K1259-E1263 PolarHBondContact O-N 2.76Å; E1263-Q1265 PolarHBondContact O-N 3.1Å
1264	G	81.6	Confident	88	Confident	21 Å²	21	29.5 Å²	29.5	22%	0.216	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	2.9	174.8	0	0	0	0	0	115.4	I1197 L1260 S1266	I1197-G1264 VanDerWaalsContact CG1-CA 3.5Å; L1260-G1264 WeakPolarHBondContact O-CA 3.12Å; L1260-G1264 PolarHBondContact O-N 2.75Å; G1264-S1266 PolarHBondContact O-N 3.19Å
1265	Q	84.5	Confident	88.5	Confident	100 Å²	100	23.8 Å²	23.8	47%	0.467	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	34.3	-176.8	-57.3	-170.6	-38.5	0	0	113.5	R997 A1261 E1263 I1267	R997-Q1265 PolarHBondContact O-NE2 3.36Å; A1261-Q1265 PolarHBondContact O-N 3.48Å; E1263-Q1265 PolarHBondContact O-N 3.1Å; Q1265-I1267 WeakPolarHBondContact O-CG1 3.38Å; Q1265-I1267 PolarHBondContact O-N 3.37Å
1266	S	87.6	Confident	88.9	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.007	13%	0.128	C	C	.	.			trans	-79.3	69.8	176.9	-52.4	0	0	0	0	110.7	A1261 G1264 K1268 F1269 M1270	A1261-S1266 PolarHBondContact O-N 3.21Å; G1264-S1266 PolarHBondContact O-N 3.19Å; S1266-K1268 VanDerWaalsContact C-N 3.33Å; S1266-K1268 PolarHBondContact O-N 3.15Å; S1266-F1269 WeakPolarHBondContact O-CB 3.46Å; S1266-F1269 PolarHBondContact O-N 2.96Å; S1266-F1269 VanDerWaalsContact O-N 3.15Å; S1266-M1270 PolarHBondContact O-N 3.47Å
1267	I	86.2	Confident	89	Confident	49 Å²	49	27.4 Å²	27.4	25%	0.251	15%	0.145	S	C	.	.	H	α-helix	trans	-59.1	-41	-170.2	-49.2	178.1	0	0	0	111.9	Q1265 M1270 A1271 Y1666	Q1265-I1267 WeakPolarHBondContact O-CG1 3.38Å; Q1265-I1267 PolarHBondContact O-N 3.37Å; I1267-M1270 PolarHBondContact O-N 3.37Å; I1267-A1271 PolarHBondContact O-N 3.25Å; I1267-A1271 VanDerWaalsContact O-N 3.1Å; I1267-Y1666 HydrophobicContact CD1-CE1 4.01Å
1268	K	87.4	Confident	89	Confident	92 Å²	92	27.8 Å²	27.8	40%	0.4	15%	0.146	S	C	.	.	H	α-helix	trans	-62.1	-44.6	177.5	-60.5	-175.5	176.2	-173.7	0	112.1	S1266 M1270 A1271 H1272	S1266-K1268 VanDerWaalsContact C-N 3.33Å; S1266-K1268 PolarHBondContact O-N 3.15Å; K1268-M1270 VanDerWaalsContact C-N 3.32Å; K1268-M1270 PolarHBondContact O-N 3.26Å; K1268-A1271 PolarHBondContact O-N 2.94Å; K1268-A1271 VanDerWaalsContact O-N 3.12Å; K1268-H1272 PolarHBondContact O-N 3.39Å
1269	F	91.8	Very high	88.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.8	-38.9	177.5	-174.1	-85.4	0	0	0	111.7	I1189 L1193 A1226 L1230 V1257 A1261 S1266 A1271 H1272 C1275	I1189-F1269 HydrophobicContact CG2-CE2 3.81Å; I1189-F1269 HydrophobicContact CG2-CZ 3.72Å; L1193-F1269 HydrophobicContact CD1-CE1 4.13Å; L1193-F1269 HydrophobicContact CD1-CE2 4.42Å; L1193-F1269 HydrophobicContact CD1-CZ 4.07Å; L1193-F1269 HydrophobicContact CD2-CD2 4.21Å; L1193-F1269 HydrophobicContact CD2-CG 4.19Å; A1226-F1269 HydrophobicContact CB-CD2 4.03Å; A1226-F1269 HydrophobicContact CB-CE2 3.98Å; L1230-F1269 HydrophobicContact CB-CE2 4.11Å; L1230-F1269 HydrophobicContact CD2-CD2 4.28Å; L1230-F1269 HydrophobicContact CD2-CE1 4.21Å; L1230-F1269 HydrophobicContact CD2-CE2 3.66Å; L1230-F1269 HydrophobicContact CD2-CZ 3.63Å; L1230-F1269 HydrophobicContact CG-CE2 4.47Å; V1257-F1269 HydrophobicContact CG1-CE1 3.93Å; V1257-F1269 HydrophobicContact CG1-CZ 3.68Å; A1261-F1269 HydrophobicContact CB-CD1 3.4Å; A1261-F1269 VanDerWaalsContact CB-CD1 3.4Å; A1261-F1269 HydrophobicContact CB-CE1 3.83Å; A1261-F1269 HydrophobicContact CB-CG 4.28Å; S1266-F1269 WeakPolarHBondContact O-CB 3.46Å; S1266-F1269 PolarHBondContact O-N 2.96Å; S1266-F1269 VanDerWaalsContact O-N 3.15Å; F1269-A1271 VanDerWaalsContact C-N 3.27Å; F1269-A1271 PolarHBondContact O-N 2.95Å; F1269-H1272 VanDerWaalsContact O-CB 3.24Å; F1269-H1272 WeakPolarHBondContact O-CB 3.4Å; F1269-H1272 PolarHBondContact O-N 2.93Å; F1269-C1275 PolarHBondContact O-SG 3.01Å; F1269-C1275 VanDerWaalsContact O-SG 3.41Å
1270	M	90	Very high	89	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-68.8	-24	176.6	-70.6	-60.3	-59.4	0	0	113.5	I1258 A1261 A1262 S1266 I1267 K1268 H1272 Q1276 Y1669 Y1672	I1258-M1270 HydrophobicContact CD1-CE 4.39Å; I1258-M1270 HydrophobicContact CG1-CE 3.95Å; I1258-M1270 HydrophobicContact CG1-SD 4.06Å; A1261-M1270 HydrophobicContact CB-CG 4.3Å; A1261-M1270 HydrophobicContact CB-SD 3.85Å; A1262-M1270 HydrophobicContact CB-CE 4.34Å; A1262-M1270 HydrophobicContact CB-SD 4.22Å; S1266-M1270 PolarHBondContact O-N 3.47Å; I1267-M1270 PolarHBondContact O-N 3.37Å; K1268-M1270 VanDerWaalsContact C-N 3.32Å; K1268-M1270 PolarHBondContact O-N 3.26Å; M1270-H1272 VanDerWaalsContact C-N 3.33Å; M1270-Q1276 PolarHBondContact O-NE2 3.22Å; M1270-Y1669 HydrophobicContact CB-CD2 4.44Å; M1270-Y1669 HydrophobicContact CG-CD2 4.22Å; M1270-Y1672 HydrophobicContact CE-CD1 4.3Å; M1270-Y1672 HydrophobicContact CE-CD2 3.55Å; M1270-Y1672 HydrophobicContact CE-CE2 4.3Å; M1270-Y1672 HydrophobicContact CE-CG 3.57Å
1271	A	89.7	Confident	88.9	Confident	18 Å²	18	29.3 Å²	29.3	15%	0.149	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-6.8	175.5	0	0	0	0	0	113.8	I1267 K1268 F1269 Y1665 N1668	I1267-A1271 PolarHBondContact O-N 3.25Å; I1267-A1271 VanDerWaalsContact O-N 3.1Å; K1268-A1271 PolarHBondContact O-N 2.94Å; K1268-A1271 VanDerWaalsContact O-N 3.12Å; F1269-A1271 VanDerWaalsContact C-N 3.27Å; F1269-A1271 PolarHBondContact O-N 2.95Å; A1271-Y1665 HydrophobicContact CB-CD1 3.47Å; A1271-Y1665 VanDerWaalsContact CB-CD1 3.47Å; A1271-Y1665 HydrophobicContact CB-CE1 3.92Å; A1271-N1668 HydrophobicContact CB-CB 4.19Å
1272	H	91.7	Very high	88.7	Confident	11 Å²	11	30 Å²	30	5%	0.051	16%	0.163	C	C	.	.	S	Bend	trans	-58.7	138.7	177.2	-171.2	-86.6	0	0	0	111.3	L1230 K1268 F1269 M1270 C1274 C1275 Q1276	L1230-H1272 HydrophobicContact CD2-CB 3.99Å; K1268-H1272 PolarHBondContact O-N 3.39Å; F1269-H1272 VanDerWaalsContact O-CB 3.24Å; F1269-H1272 WeakPolarHBondContact O-CB 3.4Å; F1269-H1272 PolarHBondContact O-N 2.93Å; M1270-H1272 VanDerWaalsContact C-N 3.33Å; H1272-C1274 VanDerWaalsContact C-N 3.29Å; H1272-C1274 VanDerWaalsContact ND1-CB 3.33Å; H1272-C1274 WeakPolarHBondContact ND1-CB 3.36Å; H1272-C1274 PolarHBondContact ND1-N 3.46Å; H1272-C1274 VanDerWaalsContact ND1-N 3.18Å; H1272-C1274 PolarHBondContact O-N 3.43Å; H1272-C1275 WeakPolarHBondContact O-CB 3.42Å; H1272-C1275 PolarHBondContact O-N 2.94Å; H1272-Q1276 PolarHBondContact O-N 3.44Å
1273	P	91.7	Very high	88.8	Confident	73 Å²	73	31.1 Å²	31.1	47%	0.474	17%	0.167	S	C	.	.	H	α-helix	trans	-51.3	-43.6	-177.9	-29.7	35.8	0	0	0	113.8	Y1234 C1275 Q1276 D1277	Y1234-P1273 HydrophobicContact CE1-CB 4.05Å; P1273-C1275 VanDerWaalsContact C-N 3.32Å; P1273-C1275 PolarHBondContact O-N 3.25Å; P1273-Q1276 CarbonylContact O-C 3.41Å; P1273-Q1276 WeakPolarHBondContact O-CA 3.35Å; P1273-Q1276 PolarHBondContact O-N 3.35Å; P1273-D1277 PolarHBondContact O-N 2.85Å
1274	C	92.1	Very high	88.9	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-53.7	-44.7	176.7	-168.7	0	0	0	0	113.7	L1230 Y1234 T1241 I1245 H1272 Q1276 F1278	L1230-C1274 HydrophobicContact CD1-CB 4.26Å; Y1234-C1274 HydrophobicContact CD1-CB 4.38Å; Y1234-C1274 HydrophobicContact CD2-CB 3.38Å; Y1234-C1274 WeakPolarHBondContact CD2-SG 3.21Å; Y1234-C1274 HydrophobicContact CE2-CB 3.75Å; Y1234-C1274 HydrophobicContact CG-CB 3.75Å; T1241-C1274 WeakPolarHBondContact CG2-SG 3.39Å; I1245-C1274 HydrophobicContact CD1-CB 4.15Å; I1245-C1274 WeakPolarHBondContact CD1-SG 3.41Å; H1272-C1274 VanDerWaalsContact C-N 3.29Å; H1272-C1274 VanDerWaalsContact ND1-CB 3.33Å; H1272-C1274 WeakPolarHBondContact ND1-CB 3.36Å; H1272-C1274 PolarHBondContact ND1-N 3.46Å; H1272-C1274 VanDerWaalsContact ND1-N 3.18Å; H1272-C1274 PolarHBondContact O-N 3.43Å; C1274-Q1276 VanDerWaalsContact C-N 3.35Å; C1274-F1278 VanDerWaalsContact O-CB 3.3Å; C1274-F1278 WeakPolarHBondContact O-CB 3.48Å; C1274-F1278 PolarHBondContact O-N 2.89Å
1275	C	91.8	Very high	89	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-40.9	177	-66.3	0	0	0	0	110.7	F1269 H1272 P1273 L1279	F1269-C1275 PolarHBondContact O-SG 3.01Å; F1269-C1275 VanDerWaalsContact O-SG 3.41Å; H1272-C1275 WeakPolarHBondContact O-CB 3.42Å; H1272-C1275 PolarHBondContact O-N 2.94Å; P1273-C1275 VanDerWaalsContact C-N 3.32Å; P1273-C1275 PolarHBondContact O-N 3.25Å; C1275-L1279 WeakPolarHBondContact O-CB 3.35Å; C1275-L1279 WeakPolarHBondContact O-CG 3.36Å; C1275-L1279 PolarHBondContact O-N 3.41Å
1276	Q	91.7	Very high	88.8	Confident	16 Å²	16	28.1 Å²	28.1	8%	0.075	16%	0.157	C	C	.	.	H	α-helix	trans	-70.6	-36.5	-179.9	-65.8	-58.5	-43.1	0	0	113	M1270 H1272 P1273 C1274 L1279 T1280 N1668	M1270-Q1276 PolarHBondContact O-NE2 3.22Å; H1272-Q1276 PolarHBondContact O-N 3.44Å; P1273-Q1276 CarbonylContact O-C 3.41Å; P1273-Q1276 WeakPolarHBondContact O-CA 3.35Å; P1273-Q1276 PolarHBondContact O-N 3.35Å; C1274-Q1276 VanDerWaalsContact C-N 3.35Å; Q1276-L1279 PolarHBondContact O-N 2.91Å; Q1276-T1280 WeakPolarHBondContact O-CB 3.41Å; Q1276-T1280 PolarHBondContact O-N 2.83Å; Q1276-T1280 PolarHBondContact O-OG1 2.72Å; Q1276-N1668 PolarHBondContact NE2-O 3.32Å
1277	D	90.3	Very high	88.6	Confident	63 Å²	63	28.5 Å²	28.5	34%	0.337	16%	0.159	S	C	.	.	H	α-helix	trans	-71.3	-40.8	175.5	-70.3	-35.3	0	0	0	111.4	Y1234 P1273 L1279 T1280 N1281	Y1234-D1277 PolarHBondContact OH-OD2 2.73Å; P1273-D1277 PolarHBondContact O-N 2.85Å; D1277-L1279 VanDerWaalsContact C-N 3.33Å; D1277-L1279 PolarHBondContact O-N 3.09Å; D1277-T1280 WeakPolarHBondContact O-CB 3.47Å; D1277-T1280 PolarHBondContact O-N 2.89Å; D1277-N1281 WeakPolarHBondContact O-CB 3.35Å; D1277-N1281 PolarHBondContact O-N 2.99Å; D1277-N1281 PolarHBondContact O-ND2 3.35Å
1278	F	90.6	Very high	88.3	Confident	11 Å²	11	27 Å²	27	5%	0.048	15%	0.154	C	C	.	.	H	α-helix	trans	-57.6	-44.6	169.5	174.2	-101.7	0	0	0	112.1	Q1242 N1246 I1258 C1274 N1281 T1282 P1718 F1719	Q1242-F1278 HydrophobicContact CB-CD2 4.25Å; Q1242-F1278 HydrophobicContact CG-CB 4.13Å; N1246-F1278 HydrophobicContact CB-CE1 4.41Å; N1246-F1278 HydrophobicContact CB-CE2 3.78Å; N1246-F1278 HydrophobicContact CB-CZ 3.6Å; N1246-F1278 WeakPolarHBondContact ND2-CE2 3.39Å; I1258-F1278 HydrophobicContact CD1-CD1 3.64Å; I1258-F1278 HydrophobicContact CD1-CE1 3.8Å; C1274-F1278 VanDerWaalsContact O-CB 3.3Å; C1274-F1278 WeakPolarHBondContact O-CB 3.48Å; C1274-F1278 PolarHBondContact O-N 2.89Å; F1278-N1281 PolarHBondContact O-N 3.26Å; F1278-T1282 WeakPolarHBondContact CZ-OG1 3.41Å; F1278-T1282 WeakPolarHBondContact O-CB 3.31Å; F1278-T1282 PolarHBondContact O-N 2.7Å; F1278-T1282 PolarHBondContact O-OG1 2.92Å; F1278-P1718 WeakPolarHBondContact CZ-O 3.38Å; F1278-F1719 AromaticContact CE1-CD1 3.97Å; F1278-F1719 HydrophobicContact CE1-CD1 3.97Å; F1278-F1719 HydrophobicContact CE1-CE1 4.16Å
1279	L	90.5	Very high	87.9	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.1	-38.9	176.8	-74.4	171.3	0	0	0	112.1	I1258 C1275 Q1276 D1277 T1282 W1283 Y1672 I1675 F1719	I1258-L1279 HydrophobicContact CD1-CD2 4.29Å; I1258-L1279 HydrophobicContact CD1-CG 4.46Å; C1275-L1279 WeakPolarHBondContact O-CB 3.35Å; C1275-L1279 WeakPolarHBondContact O-CG 3.36Å; C1275-L1279 PolarHBondContact O-N 3.41Å; Q1276-L1279 PolarHBondContact O-N 2.91Å; D1277-L1279 VanDerWaalsContact C-N 3.33Å; D1277-L1279 PolarHBondContact O-N 3.09Å; L1279-T1282 PolarHBondContact O-N 2.95Å; L1279-W1283 VanDerWaalsContact O-CB 3.23Å; L1279-W1283 WeakPolarHBondContact O-CB 3.47Å; L1279-W1283 PolarHBondContact O-N 3.41Å; L1279-Y1672 HydrophobicContact CD1-CD2 4.46Å; L1279-Y1672 HydrophobicContact CD2-CD2 3.84Å; L1279-I1675 HydrophobicContact CB-CD1 3.8Å; L1279-I1675 HydrophobicContact CD2-CD1 3.98Å; L1279-I1675 HydrophobicContact CG-CD1 4.37Å; L1279-F1719 HydrophobicContact CD2-CE1 3.72Å; L1279-F1719 HydrophobicContact CD2-CZ 4.21Å
1280	T	89.7	Confident	87.3	Confident	41 Å²	41	34.1 Å²	34.1	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-63.2	-42	174.7	-56.3	0	0	0	0	111.5	Q1276 D1277 S1284 T1289 R1671	Q1276-T1280 WeakPolarHBondContact O-CB 3.41Å; Q1276-T1280 PolarHBondContact O-N 2.83Å; Q1276-T1280 PolarHBondContact O-OG1 2.72Å; D1277-T1280 WeakPolarHBondContact O-CB 3.47Å; D1277-T1280 PolarHBondContact O-N 2.89Å; T1280-S1284 PolarHBondContact O-N 2.82Å; T1280-S1284 VanDerWaalsContact O-N 3.09Å; T1280-S1284 PolarHBondContact O-OG 3.22Å; T1280-T1289 HydrophobicContact CG2-CG2 4.24Å; T1280-R1671 PolarHBondContact OG1-NH2 3.11Å
1281	N	87.4	Confident	87	Confident	48 Å²	48	35.3 Å²	35.3	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-65.4	-42.4	175.4	-80.3	-29	0	0	0	112.2	Q1242 D1277 F1278 S1284 G1285	Q1242-N1281 PolarHBondContact OE1-ND2 2.83Å; D1277-N1281 WeakPolarHBondContact O-CB 3.35Å; D1277-N1281 PolarHBondContact O-N 2.99Å; D1277-N1281 PolarHBondContact O-ND2 3.35Å; F1278-N1281 PolarHBondContact O-N 3.26Å; N1281-S1284 PolarHBondContact O-N 3.38Å; N1281-G1285 PolarHBondContact O-N 3.01Å; N1281-G1285 VanDerWaalsContact O-N 3.09Å
1282	T	87.6	Confident	86.7	Confident	15 Å²	15	37.2 Å²	37.2	9%	0.092	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-41.4	177.4	-61.1	0	0	0	0	111.6	F1278 L1279 S1284 G1285 I1675 V1679 P1718 F1719	F1278-T1282 WeakPolarHBondContact CZ-OG1 3.41Å; F1278-T1282 WeakPolarHBondContact O-CB 3.31Å; F1278-T1282 PolarHBondContact O-N 2.7Å; F1278-T1282 PolarHBondContact O-OG1 2.92Å; L1279-T1282 PolarHBondContact O-N 2.95Å; T1282-S1284 PolarHBondContact O-N 3Å; T1282-G1285 PolarHBondContact O-N 3.38Å; T1282-I1675 HydrophobicContact CG2-CG2 4.13Å; T1282-V1679 HydrophobicContact CG2-CG2 4.08Å; T1282-P1718 HydrophobicContact CG2-CB 3.69Å; T1282-P1718 HydrophobicContact CG2-CG 3.61Å; T1282-F1719 HydrophobicContact CG2-CE2 4.43Å; T1282-F1719 HydrophobicContact CG2-CZ 4.17Å
1283	W	88.7	Confident	86.3	Confident	26 Å²	26	42 Å²	42	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-40.7	176.8	-178.3	-115	0	0	0	113	L1279 G1285 P1381 V1382 F1385 F1521 M1674 I1675	L1279-W1283 VanDerWaalsContact O-CB 3.23Å; L1279-W1283 WeakPolarHBondContact O-CB 3.47Å; L1279-W1283 PolarHBondContact O-N 3.41Å; W1283-G1285 VanDerWaalsContact C-N 3.3Å; W1283-P1381 HydrophobicContact CE3-CB 3.7Å; W1283-P1381 HydrophobicContact CZ3-CB 4Å; W1283-P1381 WeakPolarHBondContact O-CD 3.34Å; W1283-V1382 HydrophobicContact CD2-CB 4.08Å; W1283-V1382 HydrophobicContact CG-CB 4.3Å; W1283-V1382 HydrophobicContact CZ2-CB 4Å; W1283-V1382 HydrophobicContact CZ2-CG2 3.87Å; W1283-V1382 PolarHBondContact O-N 3.02Å; W1283-F1385 HydrophobicContact CH2-CB 3.49Å; W1283-F1385 VanDerWaalsContact CH2-CB 3.49Å; W1283-F1385 HydrophobicContact CH2-CD1 4.26Å; W1283-F1385 HydrophobicContact CH2-CD2 4.24Å; W1283-F1385 AromaticContact CH2-CG 3.75Å; W1283-F1385 HydrophobicContact CH2-CG 3.75Å; W1283-F1385 HydrophobicContact CZ2-CB 4.01Å; W1283-F1385 HydrophobicContact CZ2-CD1 4.16Å; W1283-F1385 HydrophobicContact CZ2-CG 4.11Å; W1283-F1385 HydrophobicContact CZ3-CB 4.42Å; W1283-F1521 HydrophobicContact CD2-CE1 4.23Å; W1283-F1521 HydrophobicContact CD2-CZ 4.05Å; W1283-F1521 AromaticContact CE2-CE1 3.61Å; W1283-F1521 AromaticContact CE2-CZ 3.91Å; W1283-F1521 HydrophobicContact CE3-CZ 4.22Å; W1283-F1521 AromaticContact CH2-CE1 3.96Å; W1283-F1521 HydrophobicContact CH2-CE1 3.96Å; W1283-F1521 HydrophobicContact CH2-CZ 4.08Å; W1283-F1521 HydrophobicContact CZ2-CD1 4.17Å; W1283-F1521 AromaticContact CZ2-CE1 3.47Å; W1283-F1521 HydrophobicContact CZ2-CE1 3.47Å; W1283-F1521 VanDerWaalsContact CZ2-CE1 3.47Å; W1283-F1521 AromaticContact CZ2-CZ 3.94Å; W1283-F1521 HydrophobicContact CZ2-CZ 3.94Å; W1283-F1521 HydrophobicContact CZ3-CZ 4.22Å; W1283-F1521 AromaticContact NE1-CE1 3.96Å; W1283-M1674 HydrophobicContact CH2-CE 3.61Å; W1283-M1674 HydrophobicContact CZ2-CE 4.47Å; W1283-M1674 HydrophobicContact CZ3-CE 4.11Å; W1283-I1675 HydrophobicContact CB-CD1 4.2Å; W1283-I1675 HydrophobicContact CB-CG1 4.43Å; W1283-I1675 HydrophobicContact CD2-CG1 4.27Å; W1283-I1675 HydrophobicContact CE3-CB 4.33Å; W1283-I1675 HydrophobicContact CE3-CG1 3.67Å; W1283-I1675 HydrophobicContact CE3-CG2 4.27Å; W1283-I1675 HydrophobicContact CZ3-CG1 4.23Å
1284	S	85.2	Confident	86.1	Confident	18 Å²	18	45.3 Å²	45.3	13%	0.126	25%	0.246	C	C	.	.	H	α-helix	trans	-74.3	-21.1	176.5	-54.8	0	0	0	0	112.8	T1280 N1281 T1282 N1286 L1287 T1289	T1280-S1284 PolarHBondContact O-N 2.82Å; T1280-S1284 VanDerWaalsContact O-N 3.09Å; T1280-S1284 PolarHBondContact O-OG 3.22Å; N1281-S1284 PolarHBondContact O-N 3.38Å; T1282-S1284 PolarHBondContact O-N 3Å; S1284-N1286 PolarHBondContact O-N 3.01Å; S1284-L1287 WeakPolarHBondContact O-CB 3.36Å; S1284-L1287 WeakPolarHBondContact O-CD1 3.46Å; S1284-L1287 PolarHBondContact O-N 2.86Å; S1284-L1287 VanDerWaalsContact O-N 3.1Å; S1284-T1289 WeakPolarHBondContact OG-CG2 3.25Å
1285	G	82.9	Confident	85.8	Confident	22 Å²	22	50.6 Å²	50.6	23%	0.227	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	-127.5	-174.4	0	0	0	0	0	112	N1281 T1282 W1283 L1287 K1317	N1281-G1285 PolarHBondContact O-N 3.01Å; N1281-G1285 VanDerWaalsContact O-N 3.09Å; T1282-G1285 PolarHBondContact O-N 3.38Å; W1283-G1285 VanDerWaalsContact C-N 3.3Å; G1285-L1287 VanDerWaalsContact C-N 3.33Å; G1285-K1317 PolarHBondContact O-NZ 3.32Å
1286	N	81.2	Confident	85.3	Confident	86 Å²	86	52.8 Å²	52.8	46%	0.46	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-3.7	178.7	-72.8	-16.4	0	0	0	113.4	S1284 K1317 D1376	S1284-N1286 PolarHBondContact O-N 3.01Å; N1286-K1317 PolarHBondContact O-N 3.21Å; N1286-K1317 VanDerWaalsContact O-N 3.09Å; N1286-D1376 HydrophobicContact CB-CB 3.84Å; N1286-D1376 PolarHBondContact ND2-OD1 2.95Å
1287	L	82.4	Confident	85	Confident	9 Å²	9	56.5 Å²	56.5	5%	0.047	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-73.8	146.8	170.1	-68.6	85	0	0	0	109.8	S1284 G1285 I1314 K1317 F1377 A1380	S1284-L1287 WeakPolarHBondContact O-CB 3.36Å; S1284-L1287 WeakPolarHBondContact O-CD1 3.46Å; S1284-L1287 PolarHBondContact O-N 2.86Å; S1284-L1287 VanDerWaalsContact O-N 3.1Å; G1285-L1287 VanDerWaalsContact C-N 3.33Å; L1287-I1314 HydrophobicContact CD2-CD1 4.39Å; L1287-I1314 HydrophobicContact CD2-CG2 3.64Å; L1287-I1314 HydrophobicContact CG-CG2 4.06Å; L1287-K1317 VanDerWaalsContact O-CE 3.29Å; L1287-K1317 WeakPolarHBondContact O-CE 3.18Å; L1287-F1377 HydrophobicContact CD2-CD2 3.98Å; L1287-F1377 HydrophobicContact CD2-CE2 4.33Å; L1287-A1380 HydrophobicContact CD1-CB 3.19Å
1288	S	80.1	Confident	84.7	Confident	19 Å²	19	57.2 Å²	57.2	13%	0.133	30%	0.296	C	S	.	.			trans	-67.4	135.4	170.6	-174.9	0	0	0	0	110.5	K1290 N1291 L1315	S1288-K1290 PolarHBondContact O-N 3.5Å; S1288-K1290 WeakPolarHBondContact OG-CB 3.31Å; S1288-K1290 PolarHBondContact OG-N 3.47Å; S1288-N1291 PolarHBondContact O-N 2.93Å; S1288-N1291 PolarHBondContact O-ND2 3.12Å; S1288-L1315 VanDerWaalsContact CB-O 3.27Å; S1288-L1315 WeakPolarHBondContact CB-O 3.48Å; S1288-L1315 PolarHBondContact N-O 3.28Å
1289	T	78.4	Confident	84.4	Confident	71 Å²	71	56.7 Å²	56.7	44%	0.436	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.7	169.7	48.6	0	0	0	0	111.9	T1280 S1284 N1291	T1280-T1289 HydrophobicContact CG2-CG2 4.24Å; S1284-T1289 WeakPolarHBondContact OG-CG2 3.25Å; T1289-N1291 PolarHBondContact O-N 3.43Å
1290	K	80.8	Confident	84.2	Confident	169 Å²	169	57.2 Å²	57.2	74%	0.735	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	6.5	175.8	-55.6	-175.5	179.1	-178	0	113.8	S1288 S1292	S1288-K1290 PolarHBondContact O-N 3.5Å; S1288-K1290 WeakPolarHBondContact OG-CB 3.31Å; S1288-K1290 PolarHBondContact OG-N 3.47Å; K1290-S1292 PolarHBondContact O-N 2.87Å
1291	N	82.2	Confident	84	Confident	26 Å²	26	58.7 Å²	58.7	14%	0.139	31%	0.306	C	S	.	.			trans	-73.3	119.8	175	-77.2	-49.5	0	0	0	109.9	S1288 T1289 L1315	S1288-N1291 PolarHBondContact O-N 2.93Å; S1288-N1291 PolarHBondContact O-ND2 3.12Å; T1289-N1291 PolarHBondContact O-N 3.43Å; N1291-L1315 PolarHBondContact ND2-O 2.89Å; N1291-L1315 WeakPolarHBondContact OD1-CB 3.27Å; N1291-L1315 PolarHBondContact OD1-N 2.78Å
1292	S	84.6	Confident	83.8	Confident	57 Å²	57	56.9 Å²	56.9	40%	0.399	30%	0.297	S	S	.	.			trans	-65.6	154.5	173.4	67.1	0	0	0	0	111	K1290 F1294 R1295 Y1296	K1290-S1292 PolarHBondContact O-N 2.87Å; S1292-F1294 PolarHBondContact O-N 3.32Å; S1292-F1294 VanDerWaalsContact O-N 3.13Å; S1292-R1295 PolarHBondContact O-N 3.09Å; S1292-R1295 PolarHBondContact OG-N 2.91Å; S1292-Y1296 PolarHBondContact O-N 2.93Å
1293	V	83.6	Confident	83.4	Confident	113 Å²	113	56.3 Å²	56.3	69%	0.685	29%	0.294	S	S	*	.	H	α-helix	trans	-52.5	-37.2	176.3	-179.5	0	0	0	0	111.2	Y1296 I1297	V1293-Y1296 WeakPolarHBondContact O-CB 3.3Å; V1293-Y1296 PolarHBondContact O-N 3.03Å; V1293-I1297 HydrophobicContact CG1-CD1 3.9Å; V1293-I1297 HydrophobicContact CG1-CG1 4.39Å; V1293-I1297 VanDerWaalsContact O-CG1 3.29Å; V1293-I1297 WeakPolarHBondContact O-CG1 3.3Å; V1293-I1297 PolarHBondContact O-N 2.77Å
1294	F	86	Confident	83	Confident	141 Å²	141	60.3 Å²	60.3	62%	0.618	32%	0.317	S	S	*	.	H	α-helix	trans	-65.1	-47.5	175.9	-176.6	-98.1	0	0	0	113.4	S1292 Y1296 I1297 M1298	S1292-F1294 PolarHBondContact O-N 3.32Å; S1292-F1294 VanDerWaalsContact O-N 3.13Å; F1294-Y1296 PolarHBondContact O-N 2.77Å; F1294-I1297 PolarHBondContact O-N 3.5Å; F1294-M1298 HydrophobicContact CE1-CE 4.12Å; F1294-M1298 HydrophobicContact CE2-CE 4.36Å; F1294-M1298 HydrophobicContact CZ-CE 3.66Å; F1294-M1298 WeakPolarHBondContact O-CB 3.49Å; F1294-M1298 PolarHBondContact O-N 2.85Å
1295	R	85.6	Confident	82.8	Confident	111 Å²	111	63.7 Å²	63.7	42%	0.419	34%	0.337	S	S	.	.	H	α-helix	trans	-61.6	-36.1	174.3	-73.5	-174.6	-172.5	146.5	2.3	111.2	S1292 G1299	S1292-R1295 PolarHBondContact O-N 3.09Å; S1292-R1295 PolarHBondContact OG-N 2.91Å; R1295-G1299 PolarHBondContact O-N 3.36Å
1296	Y	82.6	Confident	82.7	Confident	46 Å²	46	67 Å²	67	18%	0.18	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-49.8	176.3	-173.4	-96.4	0	0	0	111.5	S1292 V1293 F1294 M1298 G1299 V1300 V1382 V1383 V1386	S1292-Y1296 PolarHBondContact O-N 2.93Å; V1293-Y1296 WeakPolarHBondContact O-CB 3.3Å; V1293-Y1296 PolarHBondContact O-N 3.03Å; F1294-Y1296 PolarHBondContact O-N 2.77Å; Y1296-M1298 PolarHBondContact O-N 2.75Å; Y1296-G1299 CarbonylContact O-C 2.85Å; Y1296-G1299 WeakPolarHBondContact O-CA 3.44Å; Y1296-G1299 PolarHBondContact O-N 2.86Å; Y1296-V1300 HydrophobicContact CD1-CG2 4.15Å; Y1296-V1300 HydrophobicContact CE1-CG2 3.7Å; Y1296-V1300 WeakPolarHBondContact O-CG2 3.47Å; Y1296-V1300 PolarHBondContact O-N 2.86Å; Y1296-V1382 HydrophobicContact CE2-CG1 3.9Å; Y1296-V1382 HydrophobicContact CE2-CG2 4.18Å; Y1296-V1382 WeakPolarHBondContact OH-CG2 3.25Å; Y1296-V1382 PolarHBondContact OH-O 2.8Å; Y1296-V1383 HydrophobicContact CE2-CG2 4.45Å; Y1296-V1386 HydrophobicContact CE1-CG2 4.15Å; Y1296-V1386 WeakPolarHBondContact OH-CG2 3.15Å
1297	I	84.6	Confident	82.4	Confident	94 Å²	94	65.1 Å²	65.1	48%	0.482	34%	0.341	S	S	.	.	H	α-helix	trans	-59.4	-48.8	176.1	-69.2	166.6	0	0	0	110.6	V1293 F1294 G1299 V1300 V1301	V1293-I1297 HydrophobicContact CG1-CD1 3.9Å; V1293-I1297 HydrophobicContact CG1-CG1 4.39Å; V1293-I1297 VanDerWaalsContact O-CG1 3.29Å; V1293-I1297 WeakPolarHBondContact O-CG1 3.3Å; V1293-I1297 PolarHBondContact O-N 2.77Å; F1294-I1297 PolarHBondContact O-N 3.5Å; I1297-G1299 VanDerWaalsContact C-N 3.26Å; I1297-G1299 PolarHBondContact O-N 2.91Å; I1297-V1300 PolarHBondContact O-N 2.99Å; I1297-V1301 HydrophobicContact CG2-CG2 4.43Å; I1297-V1301 WeakPolarHBondContact O-CG2 3.3Å; I1297-V1301 PolarHBondContact O-N 2.9Å
1298	M	84.8	Confident	82.2	Confident	78 Å²	78	71.7 Å²	71.7	38%	0.384	37%	0.37	S	S	.	.	H	α-helix	trans	-60.4	-39.7	177.7	-166.8	65.9	70.8	0	0	111.1	F1294 Y1296 V1301 C1302 V1313	F1294-M1298 HydrophobicContact CE1-CE 4.12Å; F1294-M1298 HydrophobicContact CE2-CE 4.36Å; F1294-M1298 HydrophobicContact CZ-CE 3.66Å; F1294-M1298 WeakPolarHBondContact O-CB 3.49Å; F1294-M1298 PolarHBondContact O-N 2.85Å; Y1296-M1298 PolarHBondContact O-N 2.75Å; M1298-V1301 PolarHBondContact O-N 2.84Å; M1298-C1302 VanDerWaalsContact O-CB 3.25Å; M1298-C1302 WeakPolarHBondContact O-CB 3.34Å; M1298-C1302 PolarHBondContact O-N 2.8Å; M1298-C1302 PolarHBondContact O-SG 2.81Å; M1298-V1313 HydrophobicContact CB-CG1 3.76Å; M1298-V1313 HydrophobicContact CG-CG1 3.73Å
1299	G	84.5	Confident	82.2	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-61.3	-43.9	173.8	0	0	0	0	0	113.8	R1295 Y1296 I1297 G1303	R1295-G1299 PolarHBondContact O-N 3.36Å; Y1296-G1299 CarbonylContact O-C 2.85Å; Y1296-G1299 WeakPolarHBondContact O-CA 3.44Å; Y1296-G1299 PolarHBondContact O-N 2.86Å; I1297-G1299 VanDerWaalsContact C-N 3.26Å; I1297-G1299 PolarHBondContact O-N 2.91Å; G1299-G1303 PolarHBondContact O-N 2.82Å
1300	V	84.9	Confident	82.3	Confident	12 Å²	12	71 Å²	71	7%	0.073	36%	0.361	C	S	.	.	H	α-helix	trans	-64.2	-44.4	176.3	170.5	0	0	0	0	111.1	Y1296 I1297 G1303 L1304 V1386 Y1387 I1390	Y1296-V1300 HydrophobicContact CD1-CG2 4.15Å; Y1296-V1300 HydrophobicContact CE1-CG2 3.7Å; Y1296-V1300 WeakPolarHBondContact O-CG2 3.47Å; Y1296-V1300 PolarHBondContact O-N 2.86Å; I1297-V1300 PolarHBondContact O-N 2.99Å; V1300-G1303 PolarHBondContact O-N 3.18Å; V1300-L1304 PolarHBondContact O-N 2.89Å; V1300-L1304 VanDerWaalsContact O-N 3.09Å; V1300-V1386 HydrophobicContact CG1-CG1 3.93Å; V1300-V1386 HydrophobicContact CG2-CG1 4.3Å; V1300-Y1387 HydrophobicContact CG1-CE1 3.79Å; V1300-Y1387 PolarHBondContact O-OH 3.31Å; V1300-I1390 HydrophobicContact CG1-CD1 4.32Å
1301	V	85.6	Confident	81.9	Confident	71 Å²	71	64.2 Å²	64.2	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-66.4	-45	177.5	174.3	0	0	0	0	111.1	I1297 M1298 G1303 L1304 T1305	I1297-V1301 HydrophobicContact CG2-CG2 4.43Å; I1297-V1301 WeakPolarHBondContact O-CG2 3.3Å; I1297-V1301 PolarHBondContact O-N 2.9Å; M1298-V1301 PolarHBondContact O-N 2.84Å; V1301-G1303 VanDerWaalsContact C-N 3.29Å; V1301-G1303 PolarHBondContact O-N 3.2Å; V1301-L1304 PolarHBondContact O-N 3.27Å; V1301-T1305 PolarHBondContact O-N 3.04Å; V1301-T1305 PolarHBondContact O-OG1 2.9Å
1302	C	83	Confident	81.6	Confident	11 Å²	11	71.2 Å²	71.2	7%	0.074	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-34.9	173.6	-72.3	0	0	0	0	111.6	M1298 T1305 L1306 L1309	M1298-C1302 VanDerWaalsContact O-CB 3.25Å; M1298-C1302 WeakPolarHBondContact O-CB 3.34Å; M1298-C1302 PolarHBondContact O-N 2.8Å; M1298-C1302 PolarHBondContact O-SG 2.81Å; C1302-T1305 PolarHBondContact O-N 3.49Å; C1302-L1306 CarbonylContact O-C 3.57Å; C1302-L1306 WeakPolarHBondContact O-CA 3.01Å; C1302-L1306 PolarHBondContact O-N 2.82Å; C1302-L1309 HydrophobicContact CB-CB 4.24Å
1303	G	80.3	Confident	81.3	Confident	3 Å²	3	70.2 Å²	70.2	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-62.3	-42.4	174	0	0	0	0	0	112.6	G1299 V1300 V1301 Y1378 Y1387	G1299-G1303 PolarHBondContact O-N 2.82Å; V1300-G1303 PolarHBondContact O-N 3.18Å; V1301-G1303 VanDerWaalsContact C-N 3.29Å; V1301-G1303 PolarHBondContact O-N 3.2Å; G1303-Y1378 PolarHBondContact O-OH 3Å; G1303-Y1387 WeakPolarHBondContact CA-OH 3.22Å
1304	L	79.6	Confident	81.1	Confident	109 Å²	109	65.6 Å²	65.6	57%	0.571	33%	0.326	S	S	*	.	H	α-helix	trans	-68.5	-40.4	176.2	-86.4	154.4	0	0	0	113.5	V1300 V1301 Y1387 I1390	V1300-L1304 PolarHBondContact O-N 2.89Å; V1300-L1304 VanDerWaalsContact O-N 3.09Å; V1301-L1304 PolarHBondContact O-N 3.27Å; L1304-Y1387 HydrophobicContact CD1-CD1 4.25Å; L1304-Y1387 HydrophobicContact CD1-CE1 3.69Å; L1304-Y1387 HydrophobicContact CD2-CE1 4.39Å; L1304-Y1387 HydrophobicContact CG-CD1 4.3Å; L1304-Y1387 HydrophobicContact CG-CE1 3.62Å; L1304-I1390 HydrophobicContact CD1-CD1 4.48Å
1305	T	80.3	Confident	80.7	Confident	89 Å²	89	62.7 Å²	62.7	55%	0.546	32%	0.317	S	S	.	.	H	α-helix	trans	-98.8	-42.4	-169.5	55.9	0	0	0	0	113.9	V1301 C1302	V1301-T1305 PolarHBondContact O-N 3.04Å; V1301-T1305 PolarHBondContact O-OG1 2.9Å; C1302-T1305 PolarHBondContact O-N 3.49Å
1306	L	81.1	Confident	80	Confident	93 Å²	93	59.7 Å²	59.7	49%	0.487	31%	0.313	S	S	.	.			trans	-150.6	78.5	-168.2	-70	168.9	0	0	0	110.6	C1302 F1308 L1309	C1302-L1306 CarbonylContact O-C 3.57Å; C1302-L1306 WeakPolarHBondContact O-CA 3.01Å; C1302-L1306 PolarHBondContact O-N 2.82Å; L1306-F1308 PolarHBondContact O-N 3.19Å; L1306-L1309 HydrophobicContact CB-CD1 4.13Å; L1306-L1309 HydrophobicContact CB-CG 4.4Å; L1306-L1309 HydrophobicContact CD1-CD1 3.95Å; L1306-L1309 PolarHBondContact O-N 3.25Å
1307	P	76.1	Confident	79.4	Confident	45 Å²	45	61 Å²	61	29%	0.292	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-60.1	-18.7	-174.2	22.6	-34	0	0	0	113.7	L1309 I1310	P1307-L1309 PolarHBondContact O-N 3.19Å; P1307-I1310 HydrophobicContact CB-CD1 4.01Å; P1307-I1310 WeakPolarHBondContact O-CD1 3.33Å; P1307-I1310 VanDerWaalsContact O-CG1 3.29Å; P1307-I1310 WeakPolarHBondContact O-CG1 3.19Å; P1307-I1310 PolarHBondContact O-N 2.9Å
1308	F	76.7	Confident	78.2	Confident	148 Å²	148	61.9 Å²	61.9	65%	0.649	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-65.4	-22.1	174.5	-57.6	-72.7	0	0	0	113.3	L1306 Y1370	L1306-F1308 PolarHBondContact O-N 3.19Å; F1308-Y1370 PolarHBondContact O-OH 3.48Å
1309	L	81.4	Confident	76.7	Confident	72 Å²	72	65 Å²	65	38%	0.377	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-84.7	-11.1	-179.5	-67.8	174.9	0	0	0	113.7	C1302 L1306 P1307 K1312 V1313	C1302-L1309 HydrophobicContact CB-CB 4.24Å; L1306-L1309 HydrophobicContact CB-CD1 4.13Å; L1306-L1309 HydrophobicContact CB-CG 4.4Å; L1306-L1309 HydrophobicContact CD1-CD1 3.95Å; L1306-L1309 PolarHBondContact O-N 3.25Å; P1307-L1309 PolarHBondContact O-N 3.19Å; L1309-K1312 PolarHBondContact O-N 3.11Å; L1309-V1313 WeakPolarHBondContact O-CG2 3.24Å; L1309-V1313 PolarHBondContact O-N 3.17Å
1310	I	79	Confident	74.5	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.015	38%	0.378	C	S	.	.	H	α-helix	trans	-54.7	-49.6	-174.4	-60.2	165.9	0	0	0	112.5	P1307 K1312 V1313 I1314 I1374 F1377 Y1378	P1307-I1310 HydrophobicContact CB-CD1 4.01Å; P1307-I1310 WeakPolarHBondContact O-CD1 3.33Å; P1307-I1310 VanDerWaalsContact O-CG1 3.29Å; P1307-I1310 WeakPolarHBondContact O-CG1 3.19Å; P1307-I1310 PolarHBondContact O-N 2.9Å; I1310-K1312 PolarHBondContact O-N 3.22Å; I1310-V1313 PolarHBondContact O-N 3.27Å; I1310-V1313 VanDerWaalsContact O-N 3.13Å; I1310-I1314 HydrophobicContact CG2-CD1 3.94Å; I1310-I1314 HydrophobicContact CG2-CG1 4.46Å; I1310-I1314 PolarHBondContact O-N 3.47Å; I1310-I1314 VanDerWaalsContact O-N 3.12Å; I1310-I1374 HydrophobicContact CD1-CG2 4.39Å; I1310-F1377 HydrophobicContact CD1-CD1 3.73Å; I1310-F1377 HydrophobicContact CD1-CE1 4.11Å; I1310-F1377 HydrophobicContact CD1-CG 4.33Å; I1310-F1377 HydrophobicContact CG1-CD1 4.49Å; I1310-F1377 HydrophobicContact CG2-CB 3.86Å; I1310-F1377 HydrophobicContact CG2-CD1 4.27Å; I1310-F1377 HydrophobicContact CG2-CD2 4.1Å; I1310-F1377 HydrophobicContact CG2-CG 3.81Å; I1310-Y1378 HydrophobicContact CD1-CE2 4.07Å
1311	P	72.5	Confident	71.8	Confident	26 Å²	26	76.6 Å²	76.6	17%	0.169	41%	0.409	C	S	.	.	H	α-helix	trans	-57	-21.7	178	-33.7	44.2	0	0	0	115.8	Y1370 Q1373 I1374	P1311-Y1370 HydrophobicContact CB-CD2 4Å; P1311-Y1370 HydrophobicContact CB-CE2 3.7Å; P1311-Y1370 HydrophobicContact CG-CD1 3.98Å; P1311-Y1370 HydrophobicContact CG-CD2 3.93Å; P1311-Y1370 HydrophobicContact CG-CE1 3.77Å; P1311-Y1370 HydrophobicContact CG-CE2 3.75Å; P1311-Y1370 HydrophobicContact CG-CG 4.07Å; P1311-Q1373 HydrophobicContact CG-CB 4.26Å; P1311-I1374 HydrophobicContact CG-CG1 4.12Å
1312	K	76.2	Confident	69	Low	174 Å²	174	77.8 Å²	77.8	76%	0.757	42%	0.418	S	S	*	.	H	α-helix	trans	-93	-24.2	-179.8	-72.5	-172.5	174.4	-178.4	0	113.5	L1309 I1310	L1309-K1312 PolarHBondContact O-N 3.11Å; I1310-K1312 PolarHBondContact O-N 3.22Å
1313	V	78.8	Confident	66.3	Low	36 Å²	36	80 Å²	80	22%	0.218	43%	0.432	C	S	.	.	H	α-helix	trans	-98.3	-35.3	-172.1	177.5	0	0	0	0	111.7	M1298 L1309 I1310	M1298-V1313 HydrophobicContact CB-CG1 3.76Å; M1298-V1313 HydrophobicContact CG-CG1 3.73Å; L1309-V1313 WeakPolarHBondContact O-CG2 3.24Å; L1309-V1313 PolarHBondContact O-N 3.17Å; I1310-V1313 PolarHBondContact O-N 3.27Å; I1310-V1313 VanDerWaalsContact O-N 3.13Å
1314	I	79.7	Confident	63.8	Low	15 Å²	15	86.2 Å²	86.2	8%	0.077	47%	0.469	C	S	.	.	S	Bend	trans	-107.7	131.2	-172.4	-58.1	-175.5	0	0	0	110.3	L1287 I1310 S1316 F1377	L1287-I1314 HydrophobicContact CD2-CD1 4.39Å; L1287-I1314 HydrophobicContact CD2-CG2 3.64Å; L1287-I1314 HydrophobicContact CG-CG2 4.06Å; I1310-I1314 HydrophobicContact CG2-CD1 3.94Å; I1310-I1314 HydrophobicContact CG2-CG1 4.46Å; I1310-I1314 PolarHBondContact O-N 3.47Å; I1310-I1314 VanDerWaalsContact O-N 3.12Å; I1314-S1316 PolarHBondContact O-N 3.19Å; I1314-F1377 HydrophobicContact CD1-CD2 3.24Å; I1314-F1377 HydrophobicContact CD1-CE2 3.1Å; I1314-F1377 HydrophobicContact CD1-CG 4.3Å; I1314-F1377 HydrophobicContact CD1-CZ 4.05Å
1315	L	77.4	Confident	61.3	Low	81 Å²	81	89.5 Å²	89.5	42%	0.424	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-74.4	118.9	169.2	-103.1	71.5	0	0	0	109.9	S1288 N1291	S1288-L1315 VanDerWaalsContact CB-O 3.27Å; S1288-L1315 WeakPolarHBondContact CB-O 3.48Å; S1288-L1315 PolarHBondContact N-O 3.28Å; N1291-L1315 PolarHBondContact ND2-O 2.89Å; N1291-L1315 WeakPolarHBondContact OD1-CB 3.27Å; N1291-L1315 PolarHBondContact OD1-N 2.78Å
1316	S	71.2	Confident	58.8	Low	48 Å²	48	88.8 Å²	88.8	34%	0.336	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-84.9	149.4	163.7	55.5	0	0	0	0	110.8	I1314	I1314-S1316 PolarHBondContact O-N 3.19Å
1317	K	70.6	Confident	56.3	Low	74 Å²	74	93.1 Å²	93.1	32%	0.322	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-61.2	133	170.4	-69.2	174.4	176.6	167.1	0	109.6	G1285 N1286 L1287 K1319	G1285-K1317 PolarHBondContact O-NZ 3.32Å; N1286-K1317 PolarHBondContact O-N 3.21Å; N1286-K1317 VanDerWaalsContact O-N 3.09Å; L1287-K1317 VanDerWaalsContact O-CE 3.29Å; L1287-K1317 WeakPolarHBondContact O-CE 3.18Å; K1317-K1319 PolarHBondContact O-N 3.1Å
1318	P	58.6	Low	53.9	Low	112 Å²	112	100.4 Å²	100.4	73%	0.727	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-63.8	130.1	174.9	25.4	-31.4	0	0	0	109.6	T1320	P1318-T1320 PolarHBondContact O-N 2.76Å; P1318-T1320 VanDerWaalsContact O-N 3.08Å
1319	K	52.9	Low	51.6	Low	142 Å²	142	98.3 Å²	98.3	62%	0.617	54%	0.544	S	S	*	.			trans	-75.6	93.3	173.9	-70.9	176.3	-177.6	167.5	0	108.4	K1317 N1321 S1372	K1317-K1319 PolarHBondContact O-N 3.1Å; K1319-N1321 PolarHBondContact O-N 3.49Å; K1319-S1372 PolarHBondContact NZ-OG 3.01Å
1320	T	38.5	Very low	48.9	Very low	123 Å²	123	99.4 Å²	99.4	76%	0.755	56%	0.557	S	S	*	*			trans	-69	115.3	170.1	46.8	0	0	0	0	108.8	P1318 P1322	P1318-T1320 PolarHBondContact O-N 2.76Å; P1318-T1320 VanDerWaalsContact O-N 3.08Å; T1320-P1322 WeakPolarHBondContact O-CD 3.49Å
1321	N	28	Very low	46.3	Very low	133 Å²	133	103.9 Å²	103.9	71%	0.711	59%	0.586	S	S	*	*			trans	-70.8	122.6	165.9	-70.7	-38.1	0	0	0	106.8	K1319 T1323	K1319-N1321 PolarHBondContact O-N 3.49Å; N1321-T1323 PolarHBondContact O-N 2.89Å; N1321-T1323 PolarHBondContact O-OG1 3.4Å
1322	P	28	Very low	44.1	Very low	96 Å²	96	105.9 Å²	105.9	62%	0.623	60%	0.598	S	S	*	*	S	Bend	trans	-80.3	72.1	-171.8	31.9	-35.9	0	0	0	110.9	T1320	T1320-P1322 WeakPolarHBondContact O-CD 3.49Å
1323	T	26.3	Very low	41.6	Very low	59 Å²	59	99.8 Å²	99.8	36%	0.362	58%	0.577	S	S	.	*			trans	-151.8	102.1	-165.5	54.6	0	0	0	0	112.6	N929 N1321	N929-T1323 HydrophobicContact CB-CG2 4.13Å; N929-T1323 VanDerWaalsContact CG-CG2 3.49Å; N1321-T1323 PolarHBondContact O-N 2.89Å; N1321-T1323 PolarHBondContact O-OG1 3.4Å
1324	T	26.6	Very low	39	Very low	132 Å²	132	103.6 Å²	103.6	81%	0.81	59%	0.593	S	S	*	*			trans	73.6	143.5	174.3	-8.7	0	0	0	0	114.1
1325	E	28.2	Very low	36.4	Very low	178 Å²	178	108.1 Å²	108.1	83%	0.832	61%	0.614	S	S	*	*			trans	87.3	104.8	178	-51.7	168.2	-161.8	0	0	114.3
1326	G	26.9	Very low	33.9	Very low	75 Å²	75	113.1 Å²	113.1	77%	0.773	64%	0.635	S	S	*	*			cis	67.4	45.3	3.3	0	0	0	0	0	113.8
1327	E	29.7	Very low	31.7	Very low	183 Å²	183	115.2 Å²	115.2	86%	0.855	66%	0.664	S	S	*	*			trans	170.1	88.7	158.6	-98.7	167.2	-170.8	0	0	110
1328	E	25.8	Very low	29.4	Very low	199 Å²	199	116.1 Å²	116.1	93%	0.93	68%	0.68	S	S	*	*			trans	-154.6	106.5	151.4	-118.6	-176.4	-161.4	0	0	108.8
1329	S	26.5	Very low	27.8	Very low	104 Å²	104	116.2 Å²	116.2	73%	0.727	68%	0.679	S	S	*	*			trans	-170.4	128	-179.7	56.7	0	0	0	0	111.9
1330	S	24.7	Very low	26.6	Very low	95 Å²	95	117.6 Å²	117.6	66%	0.664	69%	0.687	S	S	*	*			trans	56.5	-159.4	173.2	-46.1	0	0	0	0	112.3
1331	P	25.5	Very low	25.9	Very low	96 Å²	96	116.4 Å²	116.4	62%	0.623	68%	0.684	S	S	*	*			cis	-68.3	155.5	-1.8	31.2	-37.5	0	0	0	113.3	S1333	P1331-S1333 VanDerWaalsContact C-N 3.27Å; P1331-S1333 PolarHBondContact O-N 3.04Å
1332	T	25.4	Very low	26.1	Very low	69 Å²	69	117.2 Å²	117.2	42%	0.423	69%	0.688	S	S	.	*			trans	-91.7	54.2	178	-46.8	0	0	0	0	109.9	Q1870 T1871 D1872	T1332-Q1870 CarbonylContact O-C 3.56Å; T1332-Q1870 VanDerWaalsContact O-C 3.3Å; T1332-Q1870 WeakPolarHBondContact O-CA 3.33Å; T1332-T1871 CarbonylContact O-C 3.58Å; T1332-T1871 VanDerWaalsContact O-C 3.24Å; T1332-T1871 WeakPolarHBondContact O-CA 3.47Å; T1332-T1871 PolarHBondContact O-N 3.42Å; T1332-D1872 VanDerWaalsContact N-CG 3.27Å; T1332-D1872 PolarHBondContact N-OD1 2.98Å; T1332-D1872 PolarHBondContact N-OD2 3.44Å; T1332-D1872 VanDerWaalsContact N-OD2 3.09Å; T1332-D1872 PolarHBondContact O-N 2.71Å
1333	S	24	Very low	26.1	Very low	45 Å²	45	120.7 Å²	120.7	32%	0.315	70%	0.696	S	S	.	*			trans	-115.7	-131.6	-161.8	68.1	0	0	0	0	115.5	P1331 H1869 Q1870 D1872	P1331-S1333 VanDerWaalsContact C-N 3.27Å; P1331-S1333 PolarHBondContact O-N 3.04Å; S1333-H1869 PolarHBondContact O-ND1 3.32Å; S1333-Q1870 PolarHBondContact O-N 2.96Å; S1333-D1872 WeakPolarHBondContact CB-OD2 3.32Å
1334	E	24.3	Very low	26.1	Very low	116 Å²	116	122.6 Å²	122.6	54%	0.542	71%	0.707	S	S	.	*			trans	-113.7	165.6	-130.6	-93.9	-61.6	-12.8	0	0	117.3	H1869 Q1870	E1334-H1869 PolarHBondContact O-CE1 3.48Å; E1334-Q1870 PolarHBondContact OE1-NE2 2.83Å; E1334-Q1870 VanDerWaalsContact OE2-CG 3.26Å; E1334-Q1870 WeakPolarHBondContact OE2-CG 3.23Å; E1334-Q1870 PolarHBondContact OE2-NE2 3.26Å
1335	Q	25.9	Very low	26.3	Very low	110 Å²	110	124 Å²	124	51%	0.514	71%	0.707	S	S	.	*			trans	-95.3	-174.6	-167.7	-50.4	-168.1	18.7	0	0	113.6	H1869	Q1335-H1869 HydrophobicContact CG-CB 4.07Å
1336	Q	24.5	Very low	26.3	Very low	186 Å²	186	122 Å²	122	87%	0.869	70%	0.695	S	S	*	*			trans	54.9	96.5	179.5	-76.2	-179.5	-4.2	0	0	114.8	S1338	Q1336-S1338 PolarHBondContact O-N 3.12Å
1337	G	25	Very low	26.4	Very low	92 Å²	92	126.3 Å²	126.3	95%	0.948	69%	0.69	S	S	*	*			trans	-85	95.8	154.7	0	0	0	0	0	110.1
1338	S	23.3	Very low	26.3	Very low	94 Å²	94	123 Å²	123	66%	0.657	68%	0.681	S	S	*	*			trans	-122.5	117.8	152.6	59.7	0	0	0	0	110.4	Q1336	Q1336-S1338 PolarHBondContact O-N 3.12Å
1339	T	24.2	Very low	26.5	Very low	114 Å²	114	119.5 Å²	119.5	70%	0.699	67%	0.669	S	S	*	*	S	Bend	trans	78.4	122.5	150.2	21.9	0	0	0	0	120.3
1340	Q	26.6	Very low	26.5	Very low	171 Å²	171	120.5 Å²	120.5	80%	0.799	67%	0.67	S	S	*	*			trans	76.2	34.3	147.1	-59.4	165.9	3.9	0	0	115.2
1341	S	24.3	Very low	26.7	Very low	98 Å²	98	119.5 Å²	119.5	69%	0.685	67%	0.668	S	S	*	*				40.9	112	81.7	75.4	0	0	0	0	115.7
1342	N	32	Very low	26.8	Very low	150 Å²	150	120.9 Å²	120.9	80%	0.802	67%	0.666	S	S	*	*			trans	82	135.4	168.5	-49.1	-82.7	0	0	0	119
1343	H	27.9	Very low	26.9	Very low	169 Å²	169	122.6 Å²	122.6	78%	0.782	67%	0.673	S	S	*	*			trans	-147.3	129.6	157.3	-117.8	54.8	0	0	0	110
1344	T	26.5	Very low	27.7	Very low	98 Å²	98	123.2 Å²	123.2	60%	0.601	68%	0.68	S	S	*	*				45	83.5	90.2	-9.5	0	0	0	0	112.5
1345	M	31.7	Very low	28	Very low	163 Å²	163	118.7 Å²	118.7	80%	0.803	67%	0.665	S	S	*	*				57.8	141.5	80.9	-164.5	-177.6	163.5	0	0	111.8
1346	K	28.1	Very low	28.6	Very low	135 Å²	135	123.7 Å²	123.7	59%	0.587	69%	0.685	S	S	*	*			trans	107.1	138.9	144.2	-134	169.4	178.1	-162.8	0	114.6
1347	Y	29	Very low	29.3	Very low	166 Å²	166	121 Å²	121	65%	0.651	67%	0.67	S	S	*	*			trans	96.3	101.3	164.2	-53.7	-77.1	0	0	0	117
1348	V	28.1	Very low	29.7	Very low	113 Å²	113	118.4 Å²	118.4	69%	0.685	64%	0.644	S	S	*	*			cis	77.6	137.7	38.3	-169.2	0	0	0	0	110.9
1349	L	29	Very low	30.7	Very low	126 Å²	126	118.9 Å²	118.9	66%	0.66	64%	0.643	S	S	*	*			trans	79.8	113.5	164.1	-59.6	139	0	0	0	114.5
1350	T	25.6	Very low	31.7	Very low	124 Å²	124	123.8 Å²	123.8	76%	0.761	65%	0.648	S	S	*	*	S	Bend	cis	-72.8	-177.6	5.5	56.6	0	0	0	0	112.7
1351	A	29.5	Very low	32.6	Very low	75 Å²	75	124 Å²	124	62%	0.62	65%	0.647	S	S	*	*			cis	-135.5	150.8	3.4	0	0	0	0	0	113.5
1352	E	28.6	Very low	33.8	Very low	125 Å²	125	124 Å²	124	58%	0.584	64%	0.642	S	S	*	*			trans	-99.1	-17.5	-163.5	-59.2	61.7	43.3	0	0	112.1	G1355	E1352-G1355 VanDerWaalsContact O-CA 3.22Å; E1352-G1355 WeakPolarHBondContact O-CA 3.47Å; E1352-G1355 PolarHBondContact O-N 3.28Å
1353	D	27.9	Very low	34.7	Very low	105 Å²	105	122.6 Å²	122.6	56%	0.561	63%	0.634	S	S	*	*			trans	-99.4	136.9	157.2	-146.8	59.8	0	0	0	109.8	G1355 K1357	D1353-G1355 VanDerWaalsContact CA-N 3.3Å; D1353-G1355 PolarHBondContact OD1-N 3.38Å; D1353-K1357 WeakPolarHBondContact OD1-CE 3.43Å; D1353-K1357 IonicContact OD1-NZ 3.65Å; D1353-K1357 PolarHBondContact OD1-NZ 3.41Å; D1353-K1357 IonicContact OD2-NZ 2.86Å; D1353-K1357 PolarHBondContact OD2-NZ 3.24Å
1354	A	39.7	Very low	36.1	Very low	57 Å²	57	121 Å²	121	47%	0.471	63%	0.627	S	S	.	*	S	Bend	cis	-83.6	86.6	22	0	0	0	0	0	114.8	K1356 K1357 G1358	A1354-K1356 PolarHBondContact O-N 2.76Å; A1354-K1356 VanDerWaalsContact O-N 3.16Å; A1354-K1357 HydrophobicContact CB-CB 3.95Å; A1354-K1357 HydrophobicContact CB-CD 4.15Å; A1354-K1357 HydrophobicContact CB-CG 4.38Å; A1354-K1357 PolarHBondContact O-N 3.23Å; A1354-G1358 PolarHBondContact O-N 3.48Å
1355	G	31.1	Very low	37.7	Very low	22 Å²	22	119.2 Å²	119.2	23%	0.227	62%	0.622	C	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	109.6	-160.3	0	0	0	0	0	112.2	E1352 D1353 K1357	E1352-G1355 VanDerWaalsContact O-CA 3.22Å; E1352-G1355 WeakPolarHBondContact O-CA 3.47Å; E1352-G1355 PolarHBondContact O-N 3.28Å; D1353-G1355 VanDerWaalsContact CA-N 3.3Å; D1353-G1355 PolarHBondContact OD1-N 3.38Å; G1355-K1357 WeakPolarHBondContact O-CG 3.49Å; G1355-K1357 PolarHBondContact O-N 3Å
1356	K	37.6	Very low	39.1	Very low	215 Å²	215	120.9 Å²	120.9	94%	0.935	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	65	11	-172	-55	78.5	168.5	175.8	0	113.9	A1354	A1354-K1356 PolarHBondContact O-N 2.76Å; A1354-K1356 VanDerWaalsContact O-N 3.16Å
1357	K	39.2	Very low	41.1	Very low	128 Å²	128	118 Å²	118	56%	0.557	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-42	-174.1	-41.3	171.6	-167	165.9	0	113.6	D1353 A1354 G1355 V1359	D1353-K1357 WeakPolarHBondContact OD1-CE 3.43Å; D1353-K1357 IonicContact OD1-NZ 3.65Å; D1353-K1357 PolarHBondContact OD1-NZ 3.41Å; D1353-K1357 IonicContact OD2-NZ 2.86Å; D1353-K1357 PolarHBondContact OD2-NZ 3.24Å; A1354-K1357 HydrophobicContact CB-CB 3.95Å; A1354-K1357 HydrophobicContact CB-CD 4.15Å; A1354-K1357 HydrophobicContact CB-CG 4.38Å; A1354-K1357 PolarHBondContact O-N 3.23Å; G1355-K1357 WeakPolarHBondContact O-CG 3.49Å; G1355-K1357 PolarHBondContact O-N 3Å; K1357-V1359 PolarHBondContact O-N 3.49Å
1358	G	33.6	Very low	43.2	Very low	38 Å²	38	114.7 Å²	114.7	39%	0.392	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.8	-25.7	-163.3	0	0	0	0	0	116.9	A1354 R1360 K1361	A1354-G1358 PolarHBondContact O-N 3.48Å; G1358-R1360 PolarHBondContact O-N 3.06Å; G1358-K1361 PolarHBondContact O-N 3.31Å
1359	V	45.1	Very low	45.4	Very low	105 Å²	105	114.7 Å²	114.7	64%	0.636	60%	0.603	S	S	*	*	H	α-helix	trans	-52.7	-21.4	-171.8	178	0	0	0	0	114.9	K1357 T1362	K1357-V1359 PolarHBondContact O-N 3.49Å; V1359-T1362 PolarHBondContact O-OG1 2.89Å
1360	R	45.3	Very low	47.7	Very low	217 Å²	217	112.6 Å²	112.6	82%	0.819	59%	0.587	S	S	*	*	H	α-helix	trans	-69.8	-32.9	174.7	-90.5	-179.3	171.4	166.7	-2.2	114	G1358 Q1364	G1358-R1360 PolarHBondContact O-N 3.06Å; R1360-Q1364 PolarHBondContact O-N 2.9Å
1361	K	45.2	Very low	50.4	Low	176 Å²	176	112.2 Å²	112.2	77%	0.765	58%	0.579	S	S	*	*	H	α-helix	trans	-74	-32.3	-177.9	-73.8	-173.7	177.2	-178.8	0	112.7	G1358 A1365	G1358-K1361 PolarHBondContact O-N 3.31Å; K1361-A1365 PolarHBondContact O-N 3.49Å
1362	T	49.6	Very low	52.7	Low	96 Å²	96	109.3 Å²	109.3	59%	0.589	55%	0.554	S	S	*	*	H	α-helix	trans	-76.2	-33.8	178.2	45	0	0	0	0	113	V1359 R1366	V1359-T1362 PolarHBondContact O-OG1 2.89Å; T1362-R1366 PolarHBondContact O-N 3.39Å
1363	L	50.9	Low	55.2	Low	122 Å²	122	105.6 Å²	105.6	64%	0.639	54%	0.536	S	S	*	.	H	α-helix	trans	-70.2	-35.2	175.6	-145	84.8	0	0	0	112.4	T1367	L1363-T1367 PolarHBondContact O-N 3.4Å; L1363-T1367 PolarHBondContact O-OG1 3.38Å
1364	Q	55.9	Low	57.8	Low	136 Å²	136	102.1 Å²	102.1	64%	0.636	52%	0.518	S	S	*	.	H	α-helix	trans	-71.2	-34.5	178.2	-148.5	171.5	8.4	0	0	112	R1360 T1367 V1368	R1360-Q1364 PolarHBondContact O-N 2.9Å; Q1364-T1367 WeakPolarHBondContact CA-OG1 3.5Å; Q1364-T1367 PolarHBondContact O-OG1 3.23Å; Q1364-T1367 VanDerWaalsContact O-OG1 3.07Å; Q1364-V1368 VanDerWaalsContact O-CG2 3.24Å; Q1364-V1368 WeakPolarHBondContact O-CG2 3.45Å; Q1364-V1368 PolarHBondContact O-N 3.3Å
1365	A	60.2	Low	59.9	Low	59 Å²	59	106.2 Å²	106.2	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-66.5	-46.2	174.3	0	0	0	0	0	112.4	K1361 T1367 V1368 E1369	K1361-A1365 PolarHBondContact O-N 3.49Å; A1365-T1367 PolarHBondContact O-N 3Å; A1365-V1368 PolarHBondContact O-N 3.18Å; A1365-E1369 PolarHBondContact O-N 3Å
1366	R	62	Low	62.3	Low	198 Å²	198	105.9 Å²	105.9	75%	0.747	51%	0.514	S	S	*	.	H	α-helix	trans	-63.4	-38.9	178.7	-81.5	-173.5	173	179.8	-1.2	113.5	T1362 E1369 Y1370	T1362-R1366 PolarHBondContact O-N 3.39Å; R1366-E1369 PolarHBondContact O-N 3.07Å; R1366-Y1370 WeakPolarHBondContact O-CB 3.42Å; R1366-Y1370 PolarHBondContact O-N 2.96Å
1367	T	70.6	Confident	64.6	Low	74 Å²	74	95.9 Å²	95.9	45%	0.454	47%	0.471	S	S	.	.	H	α-helix	trans	-68.7	-38.6	178.5	39.4	0	0	0	0	112.2	L1363 Q1364 A1365 Y1370 I1371	L1363-T1367 PolarHBondContact O-N 3.4Å; L1363-T1367 PolarHBondContact O-OG1 3.38Å; Q1364-T1367 WeakPolarHBondContact CA-OG1 3.5Å; Q1364-T1367 PolarHBondContact O-OG1 3.23Å; Q1364-T1367 VanDerWaalsContact O-OG1 3.07Å; A1365-T1367 PolarHBondContact O-N 3Å; T1367-Y1370 WeakPolarHBondContact O-CB 3.14Å; T1367-Y1370 PolarHBondContact O-N 3.32Å; T1367-I1371 WeakPolarHBondContact O-CG1 3.5Å; T1367-I1371 PolarHBondContact O-N 3.32Å; T1367-I1371 VanDerWaalsContact O-N 3.1Å
1368	V	73.1	Confident	66.8	Low	97 Å²	97	92.9 Å²	92.9	59%	0.588	46%	0.456	S	S	*	.	H	α-helix	trans	-66	-39.2	174.5	171.4	0	0	0	0	111.6	Q1364 A1365 I1371 S1372	Q1364-V1368 VanDerWaalsContact O-CG2 3.24Å; Q1364-V1368 WeakPolarHBondContact O-CG2 3.45Å; Q1364-V1368 PolarHBondContact O-N 3.3Å; A1365-V1368 PolarHBondContact O-N 3.18Å; V1368-I1371 PolarHBondContact O-N 3.04Å; V1368-S1372 WeakPolarHBondContact O-CB 3.34Å; V1368-S1372 PolarHBondContact O-N 3.31Å
1369	E	73.9	Confident	69.2	Low	113 Å²	113	94.1 Å²	94.1	53%	0.528	45%	0.453	S	S	.	.	H	α-helix	trans	-64.4	-42.4	175.4	-166.9	171.6	-161.3	0	0	111.9	A1365 R1366 I1371 S1372 Q1373	A1365-E1369 PolarHBondContact O-N 3Å; R1366-E1369 PolarHBondContact O-N 3.07Å; E1369-I1371 PolarHBondContact O-N 2.83Å; E1369-S1372 WeakPolarHBondContact O-CB 3.39Å; E1369-S1372 PolarHBondContact O-N 3.15Å; E1369-Q1373 WeakPolarHBondContact O-CG 3.29Å; E1369-Q1373 PolarHBondContact O-N 3.35Å
1370	Y	78.2	Confident	71.1	Confident	82 Å²	82	89.2 Å²	89.2	32%	0.322	42%	0.423	S	S	.	.	H	α-helix	trans	-59.1	-47.3	175.6	-155	-91	0	0	0	112.9	F1308 P1311 R1366 T1367 S1372 Q1373 I1374	F1308-Y1370 PolarHBondContact O-OH 3.48Å; P1311-Y1370 HydrophobicContact CB-CD2 4Å; P1311-Y1370 HydrophobicContact CB-CE2 3.7Å; P1311-Y1370 HydrophobicContact CG-CD1 3.98Å; P1311-Y1370 HydrophobicContact CG-CD2 3.93Å; P1311-Y1370 HydrophobicContact CG-CE1 3.77Å; P1311-Y1370 HydrophobicContact CG-CE2 3.75Å; P1311-Y1370 HydrophobicContact CG-CG 4.07Å; R1366-Y1370 WeakPolarHBondContact O-CB 3.42Å; R1366-Y1370 PolarHBondContact O-N 2.96Å; T1367-Y1370 WeakPolarHBondContact O-CB 3.14Å; T1367-Y1370 PolarHBondContact O-N 3.32Å; Y1370-S1372 VanDerWaalsContact C-N 3.34Å; Y1370-Q1373 PolarHBondContact O-N 3.1Å; Y1370-I1374 HydrophobicContact CD1-CD1 3.94Å; Y1370-I1374 HydrophobicContact CE1-CD1 4Å; Y1370-I1374 PolarHBondContact O-N 2.71Å
1371	I	80.8	Confident	73.1	Confident	117 Å²	117	79.2 Å²	79.2	60%	0.6	39%	0.386	S	S	*	.	H	α-helix	trans	-68	-36.2	178.6	-66.3	168.8	0	0	0	110.8	T1367 V1368 E1369 I1374 R1375	T1367-I1371 WeakPolarHBondContact O-CG1 3.5Å; T1367-I1371 PolarHBondContact O-N 3.32Å; T1367-I1371 VanDerWaalsContact O-N 3.1Å; V1368-I1371 PolarHBondContact O-N 3.04Å; E1369-I1371 PolarHBondContact O-N 2.83Å; I1371-I1374 PolarHBondContact O-N 3.5Å; I1371-R1375 PolarHBondContact O-N 2.9Å
1372	S	78.4	Confident	75.1	Confident	13 Å²	13	71.9 Å²	71.9	9%	0.091	36%	0.356	C	S	.	.	H	α-helix	trans	-59.2	-47.6	173.8	-173.3	0	0	0	0	110.9	K1319 V1368 E1369 Y1370 I1374 R1375 D1376	K1319-S1372 PolarHBondContact NZ-OG 3.01Å; V1368-S1372 WeakPolarHBondContact O-CB 3.34Å; V1368-S1372 PolarHBondContact O-N 3.31Å; E1369-S1372 WeakPolarHBondContact O-CB 3.39Å; E1369-S1372 PolarHBondContact O-N 3.15Å; Y1370-S1372 VanDerWaalsContact C-N 3.34Å; S1372-I1374 VanDerWaalsContact C-N 3.33Å; S1372-I1374 PolarHBondContact O-N 3.35Å; S1372-R1375 PolarHBondContact O-N 2.84Å; S1372-D1376 VanDerWaalsContact O-CB 3.25Å; S1372-D1376 WeakPolarHBondContact O-CB 3.43Å; S1372-D1376 PolarHBondContact O-N 3.14Å; S1372-D1376 PolarHBondContact OG-OD2 3.39Å
1373	Q	80.8	Confident	76.9	Confident	47 Å²	47	67.4 Å²	67.4	22%	0.22	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-38.5	-178.5	-71	177.4	8.6	0	0	112.6	P1311 E1369 Y1370 D1376 F1377	P1311-Q1373 HydrophobicContact CG-CB 4.26Å; E1369-Q1373 WeakPolarHBondContact O-CG 3.29Å; E1369-Q1373 PolarHBondContact O-N 3.35Å; Y1370-Q1373 PolarHBondContact O-N 3.1Å; Q1373-D1376 PolarHBondContact O-N 2.91Å; Q1373-F1377 PolarHBondContact O-N 3.2Å
1374	I	83	Confident	78.7	Confident	33 Å²	33	63.2 Å²	63.2	17%	0.169	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-45.8	174.7	-64.8	171.1	0	0	0	110.9	I1310 P1311 Y1370 I1371 S1372 D1376 F1377 Y1378	I1310-I1374 HydrophobicContact CD1-CG2 4.39Å; P1311-I1374 HydrophobicContact CG-CG1 4.12Å; Y1370-I1374 HydrophobicContact CD1-CD1 3.94Å; Y1370-I1374 HydrophobicContact CE1-CD1 4Å; Y1370-I1374 PolarHBondContact O-N 2.71Å; I1371-I1374 PolarHBondContact O-N 3.5Å; S1372-I1374 VanDerWaalsContact C-N 3.33Å; S1372-I1374 PolarHBondContact O-N 3.35Å; I1374-D1376 VanDerWaalsContact C-N 3.31Å; I1374-D1376 PolarHBondContact O-N 3.25Å; I1374-F1377 WeakPolarHBondContact O-CB 3.43Å; I1374-F1377 PolarHBondContact O-N 3Å; I1374-Y1378 HydrophobicContact CG2-CD2 4.09Å; I1374-Y1378 HydrophobicContact CG2-CE2 3.95Å; I1374-Y1378 WeakPolarHBondContact O-CD2 3.35Å; I1374-Y1378 PolarHBondContact O-N 3.19Å
1375	R	82.9	Confident	80.2	Confident	142 Å²	142	58.2 Å²	58.2	54%	0.536	28%	0.28	S	S	.	.	H	α-helix	trans	-61.3	-43.5	176.1	-176.1	-164.1	67	-172.9	-2	111.1	I1371 S1372 F1377 Y1378 M1379	I1371-R1375 PolarHBondContact O-N 2.9Å; S1372-R1375 PolarHBondContact O-N 2.84Å; R1375-F1377 VanDerWaalsContact C-N 3.25Å; R1375-F1377 PolarHBondContact O-N 3.44Å; R1375-Y1378 PolarHBondContact O-N 3.48Å; R1375-M1379 HydrophobicContact CG-CG 4.21Å; R1375-M1379 WeakPolarHBondContact O-CB 3.07Å; R1375-M1379 WeakPolarHBondContact O-CG 3.12Å; R1375-M1379 PolarHBondContact O-N 2.79Å
1376	D	81	Confident	81.5	Confident	16 Å²	16	56.9 Å²	56.9	9%	0.086	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-29.8	-177.8	-65.4	-23.7	0	0	0	111.4	N1286 S1372 Q1373 I1374	N1286-D1376 HydrophobicContact CB-CB 3.84Å; N1286-D1376 PolarHBondContact ND2-OD1 2.95Å; S1372-D1376 VanDerWaalsContact O-CB 3.25Å; S1372-D1376 WeakPolarHBondContact O-CB 3.43Å; S1372-D1376 PolarHBondContact O-N 3.14Å; S1372-D1376 PolarHBondContact OG-OD2 3.39Å; Q1373-D1376 PolarHBondContact O-N 2.91Å; I1374-D1376 VanDerWaalsContact C-N 3.31Å; I1374-D1376 PolarHBondContact O-N 3.25Å
1377	F	86.5	Confident	82.8	Confident	5 Å²	5	48.6 Å²	48.6	2%	0.022	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-54.4	170.8	175.9	-103.1	0	0	0	113.1	L1287 I1310 I1314 Q1373 I1374 R1375 M1379 A1380 V1383 Y1387	L1287-F1377 HydrophobicContact CD2-CD2 3.98Å; L1287-F1377 HydrophobicContact CD2-CE2 4.33Å; I1310-F1377 HydrophobicContact CD1-CD1 3.73Å; I1310-F1377 HydrophobicContact CD1-CE1 4.11Å; I1310-F1377 HydrophobicContact CD1-CG 4.33Å; I1310-F1377 HydrophobicContact CG1-CD1 4.49Å; I1310-F1377 HydrophobicContact CG2-CB 3.86Å; I1310-F1377 HydrophobicContact CG2-CD1 4.27Å; I1310-F1377 HydrophobicContact CG2-CD2 4.1Å; I1310-F1377 HydrophobicContact CG2-CG 3.81Å; I1314-F1377 HydrophobicContact CD1-CD2 3.24Å; I1314-F1377 HydrophobicContact CD1-CE2 3.1Å; I1314-F1377 HydrophobicContact CD1-CG 4.3Å; I1314-F1377 HydrophobicContact CD1-CZ 4.05Å; Q1373-F1377 PolarHBondContact O-N 3.2Å; I1374-F1377 WeakPolarHBondContact O-CB 3.43Å; I1374-F1377 PolarHBondContact O-N 3Å; R1375-F1377 VanDerWaalsContact C-N 3.25Å; R1375-F1377 PolarHBondContact O-N 3.44Å; F1377-M1379 PolarHBondContact O-N 2.98Å; F1377-A1380 WeakPolarHBondContact O-CB 3.22Å; F1377-A1380 PolarHBondContact O-N 3.04Å; F1377-V1383 HydrophobicContact CD1-CG1 4.27Å; F1377-V1383 HydrophobicContact CD2-CG2 3.95Å; F1377-V1383 HydrophobicContact CE1-CG1 3.8Å; F1377-V1383 HydrophobicContact CE1-CG2 4.5Å; F1377-V1383 HydrophobicContact CE2-CG1 4.35Å; F1377-V1383 HydrophobicContact CE2-CG2 3.6Å; F1377-V1383 HydrophobicContact CZ-CG1 3.85Å; F1377-V1383 HydrophobicContact CZ-CG2 3.92Å; F1377-V1383 WeakPolarHBondContact O-CG2 3.21Å; F1377-Y1387 HydrophobicContact CE1-CE2 4.12Å
1378	Y	85.2	Confident	83.6	Confident	64 Å²	64	46 Å²	46	25%	0.251	22%	0.218	S	C	.	.	H	α-helix	trans	-69.7	-18.2	-179.2	-73.3	-72.1	0	0	0	113.9	G1303 I1310 I1374 R1375 Y1387	G1303-Y1378 PolarHBondContact O-OH 3Å; I1310-Y1378 HydrophobicContact CD1-CE2 4.07Å; I1374-Y1378 HydrophobicContact CG2-CD2 4.09Å; I1374-Y1378 HydrophobicContact CG2-CE2 3.95Å; I1374-Y1378 WeakPolarHBondContact O-CD2 3.35Å; I1374-Y1378 PolarHBondContact O-N 3.19Å; R1375-Y1378 PolarHBondContact O-N 3.48Å; Y1378-Y1387 HydrophobicContact CD1-CD2 4.4Å; Y1378-Y1387 AromaticContact CD1-CE2 3.91Å; Y1378-Y1387 HydrophobicContact CD1-CE2 3.91Å; Y1378-Y1387 HydrophobicContact CE1-CD2 4.35Å; Y1378-Y1387 AromaticContact CE1-CE2 3.59Å; Y1378-Y1387 HydrophobicContact CE1-CE2 3.59Å
1379	M	84.2	Confident	84.3	Confident	65 Å²	65	42.4 Å²	42.4	32%	0.32	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.4	176.4	-70.3	-67.1	141.8	0	0	113.5	R1375 F1377 R1384 P1683 W1692	R1375-M1379 HydrophobicContact CG-CG 4.21Å; R1375-M1379 WeakPolarHBondContact O-CB 3.07Å; R1375-M1379 WeakPolarHBondContact O-CG 3.12Å; R1375-M1379 PolarHBondContact O-N 2.79Å; F1377-M1379 PolarHBondContact O-N 2.98Å; M1379-R1384 PolarHBondContact O-NH2 3.1Å; M1379-R1384 PolarHBondContact SD-NH2 3.08Å; M1379-R1384 VanDerWaalsContact SD-NH2 3.4Å; M1379-P1683 HydrophobicContact CE-CB 3.9Å; M1379-P1683 HydrophobicContact CE-CG 3.79Å; M1379-P1683 HydrophobicContact SD-CB 4.38Å; M1379-W1692 HydrophobicContact CE-CH2 3.88Å; M1379-W1692 HydrophobicContact CE-CZ3 4.36Å
1380	A	84.4	Confident	85	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.008	19%	0.188	C	C	.	.	S	Bend	trans	-72.4	131.5	-177.7	0	0	0	0	0	112.4	L1287 F1377 V1382 V1383 R1384	L1287-A1380 HydrophobicContact CD1-CB 3.19Å; F1377-A1380 WeakPolarHBondContact O-CB 3.22Å; F1377-A1380 PolarHBondContact O-N 3.04Å; A1380-V1382 VanDerWaalsContact C-N 3.28Å; A1380-V1382 HydrophobicContact CB-CG1 4.35Å; A1380-V1382 PolarHBondContact O-N 2.84Å; A1380-V1383 HydrophobicContact CB-CB 4.46Å; A1380-V1383 HydrophobicContact CB-CG2 4.15Å; A1380-V1383 PolarHBondContact O-N 3.23Å; A1380-R1384 PolarHBondContact O-N 2.66Å; A1380-R1384 VanDerWaalsContact O-N 3.11Å
1381	P	87.8	Confident	85.5	Confident	8 Å²	8	37 Å²	37	5%	0.052	18%	0.177	C	C	.	.	H	α-helix	trans	-55.5	-38.6	-178.9	-28.1	35.4	0	0	0	114	W1283 V1383 R1384 F1385 V1679	W1283-P1381 HydrophobicContact CE3-CB 3.7Å; W1283-P1381 HydrophobicContact CZ3-CB 4Å; W1283-P1381 WeakPolarHBondContact O-CD 3.34Å; P1381-V1383 VanDerWaalsContact C-N 3.31Å; P1381-V1383 PolarHBondContact O-N 3.26Å; P1381-R1384 WeakPolarHBondContact O-CB 3.32Å; P1381-R1384 PolarHBondContact O-N 3.46Å; P1381-F1385 PolarHBondContact O-N 3.31Å; P1381-V1679 HydrophobicContact CB-CG2 4.27Å; P1381-V1679 HydrophobicContact CG-CG2 3.61Å
1382	V	87.6	Confident	85.9	Confident	22 Å²	22	32.8 Å²	32.8	13%	0.133	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-38.8	177.5	69.2	0	0	0	0	112.7	W1283 Y1296 A1380 F1385 V1386	W1283-V1382 HydrophobicContact CD2-CB 4.08Å; W1283-V1382 HydrophobicContact CG-CB 4.3Å; W1283-V1382 HydrophobicContact CZ2-CB 4Å; W1283-V1382 HydrophobicContact CZ2-CG2 3.87Å; W1283-V1382 PolarHBondContact O-N 3.02Å; Y1296-V1382 HydrophobicContact CE2-CG1 3.9Å; Y1296-V1382 HydrophobicContact CE2-CG2 4.18Å; Y1296-V1382 WeakPolarHBondContact OH-CG2 3.25Å; Y1296-V1382 PolarHBondContact OH-O 2.8Å; A1380-V1382 VanDerWaalsContact C-N 3.28Å; A1380-V1382 HydrophobicContact CB-CG1 4.35Å; A1380-V1382 PolarHBondContact O-N 2.84Å; V1382-F1385 PolarHBondContact O-N 3.31Å; V1382-V1386 WeakPolarHBondContact O-CG2 3.33Å; V1382-V1386 PolarHBondContact O-N 2.94Å
1383	V	87.2	Confident	86.6	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-71.8	-39.2	178.3	177.4	0	0	0	0	110	Y1296 F1377 A1380 P1381 V1386 Y1387	Y1296-V1383 HydrophobicContact CE2-CG2 4.45Å; F1377-V1383 HydrophobicContact CD1-CG1 4.27Å; F1377-V1383 HydrophobicContact CD2-CG2 3.95Å; F1377-V1383 HydrophobicContact CE1-CG1 3.8Å; F1377-V1383 HydrophobicContact CE1-CG2 4.5Å; F1377-V1383 HydrophobicContact CE2-CG1 4.35Å; F1377-V1383 HydrophobicContact CE2-CG2 3.6Å; F1377-V1383 HydrophobicContact CZ-CG1 3.85Å; F1377-V1383 HydrophobicContact CZ-CG2 3.92Å; F1377-V1383 WeakPolarHBondContact O-CG2 3.21Å; A1380-V1383 HydrophobicContact CB-CB 4.46Å; A1380-V1383 HydrophobicContact CB-CG2 4.15Å; A1380-V1383 PolarHBondContact O-N 3.23Å; P1381-V1383 VanDerWaalsContact C-N 3.31Å; P1381-V1383 PolarHBondContact O-N 3.26Å; V1383-V1386 PolarHBondContact O-N 2.8Å; V1383-Y1387 HydrophobicContact CG1-CD2 3.49Å; V1383-Y1387 VanDerWaalsContact CG1-CD2 3.49Å; V1383-Y1387 HydrophobicContact CG1-CE2 3.27Å; V1383-Y1387 WeakPolarHBondContact O-CD2 3.25Å; V1383-Y1387 PolarHBondContact O-N 3.48Å
1384	R	88.1	Confident	87.1	Confident	33 Å²	33	36 Å²	36	13%	0.125	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-43.7	173.5	-62.8	-176.2	-175.2	169.9	0.9	112	M1379 A1380 P1381 N1388 Y1678 V1679 R1681	M1379-R1384 PolarHBondContact O-NH2 3.1Å; M1379-R1384 PolarHBondContact SD-NH2 3.08Å; M1379-R1384 VanDerWaalsContact SD-NH2 3.4Å; A1380-R1384 PolarHBondContact O-N 2.66Å; A1380-R1384 VanDerWaalsContact O-N 3.11Å; P1381-R1384 WeakPolarHBondContact O-CB 3.32Å; P1381-R1384 PolarHBondContact O-N 3.46Å; R1384-N1388 WeakPolarHBondContact O-CB 3.28Å; R1384-N1388 PolarHBondContact O-N 3.44Å; R1384-Y1678 PolarHBondContact NH1-O 2.91Å; R1384-V1679 PolarHBondContact NH1-O 3.13Å; R1384-R1681 PolarHBondContact NH1-O 3.49Å
1385	F	88.7	Confident	87.5	Confident	31 Å²	31	34.5 Å²	34.5	14%	0.136	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-53.2	174.7	171.1	-99.5	0	0	0	111	W1283 P1381 V1382 Y1387 N1388 T1389 T1518 M1674 Y1678	W1283-F1385 HydrophobicContact CH2-CB 3.49Å; W1283-F1385 VanDerWaalsContact CH2-CB 3.49Å; W1283-F1385 HydrophobicContact CH2-CD1 4.26Å; W1283-F1385 HydrophobicContact CH2-CD2 4.24Å; W1283-F1385 AromaticContact CH2-CG 3.75Å; W1283-F1385 HydrophobicContact CH2-CG 3.75Å; W1283-F1385 HydrophobicContact CZ2-CB 4.01Å; W1283-F1385 HydrophobicContact CZ2-CD1 4.16Å; W1283-F1385 HydrophobicContact CZ2-CG 4.11Å; W1283-F1385 HydrophobicContact CZ3-CB 4.42Å; P1381-F1385 PolarHBondContact O-N 3.31Å; V1382-F1385 PolarHBondContact O-N 3.31Å; F1385-Y1387 PolarHBondContact O-N 3.41Å; F1385-N1388 PolarHBondContact O-N 3.36Å; F1385-T1389 WeakPolarHBondContact O-CB 3.3Å; F1385-T1389 PolarHBondContact O-N 3.45Å; F1385-T1389 PolarHBondContact O-OG1 3.28Å; F1385-T1518 HydrophobicContact CE2-CG2 3.94Å; F1385-T1518 HydrophobicContact CZ-CG2 3.71Å; F1385-M1674 HydrophobicContact CD2-CE 3.55Å; F1385-M1674 HydrophobicContact CD2-SD 4.35Å; F1385-M1674 HydrophobicContact CE2-CE 3.65Å; F1385-M1674 HydrophobicContact CE2-SD 4.03Å; F1385-M1674 HydrophobicContact CG-CE 4.29Å; F1385-M1674 HydrophobicContact CZ-CE 4.45Å; F1385-Y1678 HydrophobicContact CB-CD1 4.05Å; F1385-Y1678 HydrophobicContact CB-CE1 4.06Å; F1385-Y1678 HydrophobicContact CB-CG 4.31Å; F1385-Y1678 HydrophobicContact CD2-CD2 4.19Å; F1385-Y1678 HydrophobicContact CD2-CE1 4.03Å; F1385-Y1678 AromaticContact CD2-CE2 3.57Å; F1385-Y1678 HydrophobicContact CD2-CE2 3.57Å; F1385-Y1678 AromaticContact CD2-CZ 3.47Å; F1385-Y1678 VanDerWaalsContact CD2-CZ 3.47Å; F1385-Y1678 HydrophobicContact CE2-CE2 4.28Å
1386	V	88	Confident	87.9	Confident	31 Å²	31	28 Å²	28	19%	0.188	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-47	-177.8	171.4	0	0	0	0	111.8	Y1296 V1300 V1382 V1383 T1389 I1390	Y1296-V1386 HydrophobicContact CE1-CG2 4.15Å; Y1296-V1386 WeakPolarHBondContact OH-CG2 3.15Å; V1300-V1386 HydrophobicContact CG1-CG1 3.93Å; V1300-V1386 HydrophobicContact CG2-CG1 4.3Å; V1382-V1386 WeakPolarHBondContact O-CG2 3.33Å; V1382-V1386 PolarHBondContact O-N 2.94Å; V1383-V1386 PolarHBondContact O-N 2.8Å; V1386-T1389 PolarHBondContact O-N 3.26Å; V1386-I1390 HydrophobicContact CG1-CD1 3.7Å; V1386-I1390 HydrophobicContact CG1-CG1 4.39Å; V1386-I1390 VanDerWaalsContact O-CG1 3.3Å; V1386-I1390 WeakPolarHBondContact O-CG1 3.19Å; V1386-I1390 PolarHBondContact O-N 3.36Å
1387	Y	88.3	Confident	88.5	Confident	24 Å²	24	32.1 Å²	32.1	9%	0.094	16%	0.162	C	C	.	.	H	α-helix	trans	-68	-36.6	178.2	-71.2	-36.8	0	0	0	113.1	V1300 G1303 L1304 F1377 Y1378 V1383 F1385 I1390 S1391	V1300-Y1387 HydrophobicContact CG1-CE1 3.79Å; V1300-Y1387 PolarHBondContact O-OH 3.31Å; G1303-Y1387 WeakPolarHBondContact CA-OH 3.22Å; L1304-Y1387 HydrophobicContact CD1-CD1 4.25Å; L1304-Y1387 HydrophobicContact CD1-CE1 3.69Å; L1304-Y1387 HydrophobicContact CD2-CE1 4.39Å; L1304-Y1387 HydrophobicContact CG-CD1 4.3Å; L1304-Y1387 HydrophobicContact CG-CE1 3.62Å; F1377-Y1387 HydrophobicContact CE1-CE2 4.12Å; Y1378-Y1387 HydrophobicContact CD1-CD2 4.4Å; Y1378-Y1387 AromaticContact CD1-CE2 3.91Å; Y1378-Y1387 HydrophobicContact CD1-CE2 3.91Å; Y1378-Y1387 HydrophobicContact CE1-CD2 4.35Å; Y1378-Y1387 AromaticContact CE1-CE2 3.59Å; Y1378-Y1387 HydrophobicContact CE1-CE2 3.59Å; V1383-Y1387 HydrophobicContact CG1-CD2 3.49Å; V1383-Y1387 VanDerWaalsContact CG1-CD2 3.49Å; V1383-Y1387 HydrophobicContact CG1-CE2 3.27Å; V1383-Y1387 WeakPolarHBondContact O-CD2 3.25Å; V1383-Y1387 PolarHBondContact O-N 3.48Å; F1385-Y1387 PolarHBondContact O-N 3.41Å; Y1387-I1390 HydrophobicContact CD1-CD1 4.45Å; Y1387-S1391 VanDerWaalsContact O-CB 3.24Å; Y1387-S1391 WeakPolarHBondContact O-CB 3.43Å; Y1387-S1391 PolarHBondContact O-N 3.42Å; Y1387-S1391 PolarHBondContact O-OG 3.42Å
1388	N	86.9	Confident	88.8	Confident	19 Å²	19	34.1 Å²	34.1	10%	0.102	17%	0.173	C	C	.	.	H	α-helix	trans	-62.4	-44.5	172.7	-176.7	77.4	0	0	0	111	R1384 F1385 S1391 Y1392 Y1678 R1681	R1384-N1388 WeakPolarHBondContact O-CB 3.28Å; R1384-N1388 PolarHBondContact O-N 3.44Å; F1385-N1388 PolarHBondContact O-N 3.36Å; N1388-S1391 WeakPolarHBondContact CA-OG 3.32Å; N1388-S1391 PolarHBondContact O-N 3.04Å; N1388-S1391 PolarHBondContact O-OG 3.41Å; N1388-Y1392 WeakPolarHBondContact O-CB 3.46Å; N1388-Y1392 PolarHBondContact O-N 3.22Å; N1388-Y1678 HydrophobicContact CB-CE1 4.31Å; N1388-R1681 PolarHBondContact ND2-NH1 2.75Å; N1388-R1681 VanDerWaalsContact OD1-CZ 3.3Å; N1388-R1681 PolarHBondContact OD1-NH2 2.64Å
1389	T	88.3	Confident	89.1	Confident	22 Å²	22	31.1 Å²	31.1	14%	0.135	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-46.3	177.5	-60.8	0	0	0	0	112.1	F1385 V1386 S1391 Y1392 I1393 T1518	F1385-T1389 WeakPolarHBondContact O-CB 3.3Å; F1385-T1389 PolarHBondContact O-N 3.45Å; F1385-T1389 PolarHBondContact O-OG1 3.28Å; V1386-T1389 PolarHBondContact O-N 3.26Å; T1389-S1391 VanDerWaalsContact C-N 3.33Å; T1389-S1391 PolarHBondContact O-N 3.2Å; T1389-Y1392 PolarHBondContact O-N 3.06Å; T1389-I1393 HydrophobicContact CG2-CD1 3.96Å; T1389-I1393 WeakPolarHBondContact O-CG1 3.5Å; T1389-I1393 PolarHBondContact O-N 3.41Å; T1389-T1518 HydrophobicContact CG2-CG2 3.81Å
1390	I	88.6	Confident	89.6	Confident	68 Å²	68	28.8 Å²	28.8	35%	0.349	15%	0.151	S	C	.	.	H	α-helix	trans	-61.2	-43.3	175.9	-68.1	168.3	0	0	0	110.7	V1300 L1304 V1386 Y1387 Y1392 I1393 T1394	V1300-I1390 HydrophobicContact CG1-CD1 4.32Å; L1304-I1390 HydrophobicContact CD1-CD1 4.48Å; V1386-I1390 HydrophobicContact CG1-CD1 3.7Å; V1386-I1390 HydrophobicContact CG1-CG1 4.39Å; V1386-I1390 VanDerWaalsContact O-CG1 3.3Å; V1386-I1390 WeakPolarHBondContact O-CG1 3.19Å; V1386-I1390 PolarHBondContact O-N 3.36Å; Y1387-I1390 HydrophobicContact CD1-CD1 4.45Å; I1390-Y1392 VanDerWaalsContact C-N 3.31Å; I1390-Y1392 PolarHBondContact O-N 3.46Å; I1390-I1393 PolarHBondContact O-N 3.45Å; I1390-T1394 WeakPolarHBondContact O-CB 3.38Å; I1390-T1394 PolarHBondContact O-N 3.1Å; I1390-T1394 PolarHBondContact O-OG1 3.47Å
1391	S	88.6	Confident	90	Very high	13 Å²	13	34 Å²	34	9%	0.091	17%	0.172	C	C	.	.	H	α-helix	trans	-63.3	-38.1	177.9	78	0	0	0	0	112	Y1387 N1388 T1389 T1394 F1395 W1421	Y1387-S1391 VanDerWaalsContact O-CB 3.24Å; Y1387-S1391 WeakPolarHBondContact O-CB 3.43Å; Y1387-S1391 PolarHBondContact O-N 3.42Å; Y1387-S1391 PolarHBondContact O-OG 3.42Å; N1388-S1391 WeakPolarHBondContact CA-OG 3.32Å; N1388-S1391 PolarHBondContact O-N 3.04Å; N1388-S1391 PolarHBondContact O-OG 3.41Å; T1389-S1391 VanDerWaalsContact C-N 3.33Å; T1389-S1391 PolarHBondContact O-N 3.2Å; S1391-T1394 PolarHBondContact O-N 3.06Å; S1391-F1395 WeakPolarHBondContact O-CB 3.35Å; S1391-F1395 PolarHBondContact O-N 2.9Å; S1391-W1421 WeakPolarHBondContact O-CZ2 3.48Å
1392	Y	90	Very high	90.1	Very high	29 Å²	29	33.9 Å²	33.9	11%	0.114	17%	0.17	C	C	.	.	H	α-helix	trans	-70.1	-43.7	179	-167	-105.1	0	0	0	112	N1388 T1389 I1390 T1394 F1395 L1396 F1511 R1514 L1515	N1388-Y1392 WeakPolarHBondContact O-CB 3.46Å; N1388-Y1392 PolarHBondContact O-N 3.22Å; T1389-Y1392 PolarHBondContact O-N 3.06Å; I1390-Y1392 VanDerWaalsContact C-N 3.31Å; I1390-Y1392 PolarHBondContact O-N 3.46Å; Y1392-T1394 VanDerWaalsContact C-N 3.3Å; Y1392-T1394 PolarHBondContact O-N 3.44Å; Y1392-F1395 HydrophobicContact CD2-CD1 4.41Å; Y1392-F1395 HydrophobicContact CE2-CD1 4.32Å; Y1392-F1395 WeakPolarHBondContact O-CB 3.44Å; Y1392-F1395 PolarHBondContact O-N 3.03Å; Y1392-L1396 HydrophobicContact CD1-CD1 4.04Å; Y1392-L1396 HydrophobicContact CD1-CG 4.39Å; Y1392-L1396 HydrophobicContact CE1-CD1 3.82Å; Y1392-L1396 HydrophobicContact CE1-CD2 4.47Å; Y1392-L1396 HydrophobicContact CE1-CG 4.19Å; Y1392-L1396 WeakPolarHBondContact O-CG 3.46Å; Y1392-L1396 PolarHBondContact O-N 3.27Å; Y1392-F1511 PolarHBondContact OH-O 2.79Å; Y1392-R1514 WeakPolarHBondContact OH-CB 3.22Å; Y1392-R1514 WeakPolarHBondContact OH-CG 3.37Å; Y1392-L1515 HydrophobicContact CD1-CD1 4.08Å; Y1392-L1515 HydrophobicContact CE1-CD1 4.36Å
1393	I	92.1	Very high	90.2	Very high	72 Å²	72	33.3 Å²	33.3	37%	0.369	17%	0.167	S	C	.	.	H	α-helix	trans	-61.6	-41.4	174	-67.3	168.4	0	0	0	110.3	T1389 I1390 F1395 L1396 I1397 L1515	T1389-I1393 HydrophobicContact CG2-CD1 3.96Å; T1389-I1393 WeakPolarHBondContact O-CG1 3.5Å; T1389-I1393 PolarHBondContact O-N 3.41Å; I1390-I1393 PolarHBondContact O-N 3.45Å; I1393-F1395 PolarHBondContact O-N 3.2Å; I1393-L1396 PolarHBondContact O-N 3.03Å; I1393-I1397 HydrophobicContact CG2-CD1 3.88Å; I1393-I1397 VanDerWaalsContact O-CG1 3.3Å; I1393-I1397 WeakPolarHBondContact O-CG1 3.31Å; I1393-I1397 PolarHBondContact O-N 3.37Å; I1393-L1515 HydrophobicContact CG1-CD1 4.25Å
1394	T	90.8	Very high	90.3	Very high	57 Å²	57	39.8 Å²	39.8	35%	0.35	20%	0.2	S	C	.	.	H	α-helix	trans	-63.7	-41.4	176.4	-53.9	0	0	0	0	111.5	I1390 S1391 Y1392 I1397 L1398	I1390-T1394 WeakPolarHBondContact O-CB 3.38Å; I1390-T1394 PolarHBondContact O-N 3.1Å; I1390-T1394 PolarHBondContact O-OG1 3.47Å; S1391-T1394 PolarHBondContact O-N 3.06Å; Y1392-T1394 VanDerWaalsContact C-N 3.3Å; Y1392-T1394 PolarHBondContact O-N 3.44Å; T1394-I1397 PolarHBondContact O-N 3.4Å; T1394-L1398 HydrophobicContact CG2-CD1 4.06Å; T1394-L1398 HydrophobicContact CG2-CG 4.43Å; T1394-L1398 WeakPolarHBondContact O-CB 3.32Å; T1394-L1398 WeakPolarHBondContact O-CG 3.28Å; T1394-L1398 PolarHBondContact O-N 3.19Å
1395	F	91.9	Very high	90.3	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-58.8	-47	173	163	-103	0	0	0	112	S1391 Y1392 I1393 I1397 L1398 F1399 V1418 W1421 V1422 L1425 F1511	S1391-F1395 WeakPolarHBondContact O-CB 3.35Å; S1391-F1395 PolarHBondContact O-N 2.9Å; Y1392-F1395 HydrophobicContact CD2-CD1 4.41Å; Y1392-F1395 HydrophobicContact CE2-CD1 4.32Å; Y1392-F1395 WeakPolarHBondContact O-CB 3.44Å; Y1392-F1395 PolarHBondContact O-N 3.03Å; I1393-F1395 PolarHBondContact O-N 3.2Å; F1395-I1397 VanDerWaalsContact C-N 3.34Å; F1395-I1397 PolarHBondContact O-N 3.38Å; F1395-L1398 PolarHBondContact O-N 3.38Å; F1395-F1399 HydrophobicContact CE2-CB 4.43Å; F1395-F1399 AromaticContact CZ-CD1 3.97Å; F1395-F1399 HydrophobicContact CZ-CD1 3.97Å; F1395-F1399 WeakPolarHBondContact O-CB 3.48Å; F1395-F1399 PolarHBondContact O-N 3.05Å; F1395-V1418 HydrophobicContact CE2-CG1 4.25Å; F1395-W1421 HydrophobicContact CB-CD2 4.41Å; F1395-W1421 HydrophobicContact CB-CG 4.45Å; F1395-W1421 HydrophobicContact CB-CZ2 4.5Å; F1395-W1421 HydrophobicContact CD2-CB 3.97Å; F1395-W1421 AromaticContact CD2-CD1 3.82Å; F1395-W1421 HydrophobicContact CD2-CD2 4.46Å; F1395-W1421 AromaticContact CD2-CG 3.83Å; F1395-W1421 HydrophobicContact CD2-CG 3.83Å; F1395-W1421 HydrophobicContact CE2-CB 4.36Å; F1395-W1421 HydrophobicContact CG-CG 4.47Å; F1395-V1422 HydrophobicContact CE2-CG2 3.73Å; F1395-V1422 HydrophobicContact CZ-CG2 3.97Å; F1395-L1425 HydrophobicContact CD1-CD1 4.42Å; F1395-L1425 HydrophobicContact CE1-CD1 4.12Å; F1395-L1425 HydrophobicContact CE2-CD1 4.41Å; F1395-L1425 HydrophobicContact CZ-CD1 4.12Å; F1395-F1511 HydrophobicContact CE1-CB 4.41Å; F1395-F1511 HydrophobicContact CE1-CD1 4.43Å; F1395-F1511 HydrophobicContact CE1-CD2 4.17Å; F1395-F1511 HydrophobicContact CE1-CG 4.11Å; F1395-F1511 HydrophobicContact CZ-CD2 4.25Å; F1395-F1511 HydrophobicContact CZ-CE2 4.28Å
1396	L	92.6	Very high	90	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-41.7	177.2	-68.9	177.2	0	0	0	112	Y1392 I1393 S1400 L1508 F1511 Y1512 L1515	Y1392-L1396 HydrophobicContact CD1-CD1 4.04Å; Y1392-L1396 HydrophobicContact CD1-CG 4.39Å; Y1392-L1396 HydrophobicContact CE1-CD1 3.82Å; Y1392-L1396 HydrophobicContact CE1-CD2 4.47Å; Y1392-L1396 HydrophobicContact CE1-CG 4.19Å; Y1392-L1396 WeakPolarHBondContact O-CG 3.46Å; Y1392-L1396 PolarHBondContact O-N 3.27Å; I1393-L1396 PolarHBondContact O-N 3.03Å; L1396-S1400 VanDerWaalsContact O-CB 3.25Å; L1396-S1400 WeakPolarHBondContact O-CB 3.19Å; L1396-S1400 PolarHBondContact O-N 2.87Å; L1396-S1400 PolarHBondContact O-OG 3.04Å; L1396-L1508 HydrophobicContact CD2-CD1 4.2Å; L1396-F1511 HydrophobicContact CD2-CB 3.75Å; L1396-Y1512 HydrophobicContact CD1-CD1 4.17Å; L1396-Y1512 HydrophobicContact CD1-CE1 4.18Å; L1396-Y1512 HydrophobicContact CD2-CD2 4.38Å; L1396-L1515 HydrophobicContact CD1-CD1 4.45Å; L1396-L1515 HydrophobicContact CD1-CD2 4.49Å
1397	I	93.3	Very high	89.8	Confident	104 Å²	104	42.2 Å²	42.2	53%	0.533	22%	0.218	S	C	.	.	H	α-helix	trans	-64.3	-45.8	176.9	-68.1	166.9	0	0	0	110.8	I1393 T1394 F1395 S1400 Y1401	I1393-I1397 HydrophobicContact CG2-CD1 3.88Å; I1393-I1397 VanDerWaalsContact O-CG1 3.3Å; I1393-I1397 WeakPolarHBondContact O-CG1 3.31Å; I1393-I1397 PolarHBondContact O-N 3.37Å; T1394-I1397 PolarHBondContact O-N 3.4Å; F1395-I1397 VanDerWaalsContact C-N 3.34Å; F1395-I1397 PolarHBondContact O-N 3.38Å; I1397-S1400 PolarHBondContact O-N 3.3Å; I1397-Y1401 WeakPolarHBondContact O-CB 3.42Å; I1397-Y1401 PolarHBondContact O-N 3.44Å
1398	L	91.7	Very high	89.3	Confident	46 Å²	46	47.8 Å²	47.8	24%	0.241	24%	0.239	C	C	.	.	H	α-helix	trans	-66.7	-41.2	178.9	-73.6	172.7	0	0	0	112.3	T1394 F1395 Y1401 L1402 V1414 I1417 V1418 W1421	T1394-L1398 HydrophobicContact CG2-CD1 4.06Å; T1394-L1398 HydrophobicContact CG2-CG 4.43Å; T1394-L1398 WeakPolarHBondContact O-CB 3.32Å; T1394-L1398 WeakPolarHBondContact O-CG 3.28Å; T1394-L1398 PolarHBondContact O-N 3.19Å; F1395-L1398 PolarHBondContact O-N 3.38Å; L1398-Y1401 PolarHBondContact O-N 3.42Å; L1398-L1402 WeakPolarHBondContact O-CB 3.5Å; L1398-L1402 PolarHBondContact O-N 3.45Å; L1398-V1414 HydrophobicContact CD2-CG1 4.44Å; L1398-I1417 HydrophobicContact CD1-CG2 4.31Å; L1398-V1418 HydrophobicContact CB-CG2 4.22Å; L1398-W1421 HydrophobicContact CD1-CZ3 4.25Å
1399	F	93	Very high	88.7	Confident	1 Å²	1	47.4 Å²	47.4	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-68.8	-36.8	178.1	-170.4	-162.1	0	0	0	111.5	F1395 L1402 L1403 V1418 Y1462 L1504 L1508 F1511	F1395-F1399 HydrophobicContact CE2-CB 4.43Å; F1395-F1399 AromaticContact CZ-CD1 3.97Å; F1395-F1399 HydrophobicContact CZ-CD1 3.97Å; F1395-F1399 WeakPolarHBondContact O-CB 3.48Å; F1395-F1399 PolarHBondContact O-N 3.05Å; F1399-L1402 HydrophobicContact CD2-CD2 4.22Å; F1399-L1402 WeakPolarHBondContact O-CB 3.29Å; F1399-L1402 PolarHBondContact O-N 3.1Å; F1399-L1403 HydrophobicContact CD2-CD1 4.11Å; F1399-L1403 HydrophobicContact CD2-CG 4.19Å; F1399-L1403 HydrophobicContact CE2-CD1 3.64Å; F1399-L1403 HydrophobicContact CE2-CD2 4.46Å; F1399-L1403 HydrophobicContact CE2-CG 3.88Å; F1399-L1403 HydrophobicContact CZ-CD1 3.99Å; F1399-L1403 PolarHBondContact O-N 3.09Å; F1399-L1403 VanDerWaalsContact O-N 3.07Å; F1399-V1418 HydrophobicContact CB-CG1 4.3Å; F1399-V1418 HydrophobicContact CD2-CG1 3.95Å; F1399-V1418 HydrophobicContact CG-CG1 4.17Å; F1399-Y1462 HydrophobicContact CE1-CD2 4.2Å; F1399-Y1462 HydrophobicContact CE1-CE2 4.4Å; F1399-Y1462 HydrophobicContact CE2-CD2 4.48Å; F1399-Y1462 HydrophobicContact CE2-CE2 4.07Å; F1399-Y1462 AromaticContact CZ-CD2 3.79Å; F1399-Y1462 HydrophobicContact CZ-CD2 3.79Å; F1399-Y1462 AromaticContact CZ-CE2 3.83Å; F1399-Y1462 HydrophobicContact CZ-CE2 3.83Å; F1399-L1504 HydrophobicContact CZ-CB 4.38Å; F1399-L1504 HydrophobicContact CZ-CD2 4.34Å; F1399-L1508 HydrophobicContact CB-CD1 4.14Å; F1399-L1508 HydrophobicContact CD1-CB 4.06Å; F1399-L1508 HydrophobicContact CD1-CD1 3.53Å; F1399-L1508 HydrophobicContact CD1-CG 4.34Å; F1399-L1508 HydrophobicContact CE1-CB 3.78Å; F1399-L1508 HydrophobicContact CE1-CD1 4.16Å; F1399-L1508 HydrophobicContact CG-CD1 3.99Å; F1399-L1508 HydrophobicContact CZ-CB 4.28Å; F1399-F1511 HydrophobicContact CD1-CD2 4.42Å; F1399-F1511 HydrophobicContact CE1-CD2 4.12Å; F1399-F1511 HydrophobicContact CE1-CE2 4.36Å
1400	S	94	Very high	88.2	Confident	17 Å²	17	51.8 Å²	51.8	12%	0.119	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-44.3	171.6	-58.1	0	0	0	0	111.9	L1396 I1397 L1402 L1403 L1404 Y1512	L1396-S1400 VanDerWaalsContact O-CB 3.25Å; L1396-S1400 WeakPolarHBondContact O-CB 3.19Å; L1396-S1400 PolarHBondContact O-N 2.87Å; L1396-S1400 PolarHBondContact O-OG 3.04Å; I1397-S1400 PolarHBondContact O-N 3.3Å; S1400-L1402 VanDerWaalsContact C-N 3.32Å; S1400-L1402 PolarHBondContact O-N 3.46Å; S1400-L1403 PolarHBondContact O-N 3.36Å; S1400-L1404 VanDerWaalsContact O-CB 3.29Å; S1400-L1404 WeakPolarHBondContact O-CB 3.35Å; S1400-L1404 WeakPolarHBondContact O-CG 3.5Å; S1400-L1404 PolarHBondContact O-N 2.82Å; S1400-Y1512 PolarHBondContact OG-OH 3.12Å
1401	Y	92.7	Very high	87.9	Confident	111 Å²	111	51 Å²	51	44%	0.435	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-41.3	175.8	178.8	-96.1	0	0	0	111.8	I1397 L1398 V1405 D1406 V1414	I1397-Y1401 WeakPolarHBondContact O-CB 3.42Å; I1397-Y1401 PolarHBondContact O-N 3.44Å; L1398-Y1401 PolarHBondContact O-N 3.42Å; Y1401-V1405 HydrophobicContact CD2-CB 4.02Å; Y1401-V1405 HydrophobicContact CD2-CG2 3.93Å; Y1401-V1405 HydrophobicContact CE2-CB 3.8Å; Y1401-V1405 HydrophobicContact CE2-CG1 3.82Å; Y1401-V1405 HydrophobicContact CE2-CG2 3.95Å; Y1401-V1405 WeakPolarHBondContact O-CB 3.37Å; Y1401-V1405 PolarHBondContact O-N 2.77Å; Y1401-D1406 HydrophobicContact CE1-CB 4.06Å; Y1401-D1406 PolarHBondContact O-N 3.33Å; Y1401-V1414 HydrophobicContact CD1-CG1 4.22Å; Y1401-V1414 HydrophobicContact CD1-CG2 4.45Å; Y1401-V1414 HydrophobicContact CE1-CG2 4.22Å
1402	L	90.7	Very high	87.8	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-51.2	174.5	175.7	65.4	0	0	0	111.4	L1398 F1399 S1400 D1406 F1407 V1414 E1415 V1418	L1398-L1402 WeakPolarHBondContact O-CB 3.5Å; L1398-L1402 PolarHBondContact O-N 3.45Å; F1399-L1402 HydrophobicContact CD2-CD2 4.22Å; F1399-L1402 WeakPolarHBondContact O-CB 3.29Å; F1399-L1402 PolarHBondContact O-N 3.1Å; S1400-L1402 VanDerWaalsContact C-N 3.32Å; S1400-L1402 PolarHBondContact O-N 3.46Å; L1402-D1406 CarbonylContact O-C 3.59Å; L1402-D1406 PolarHBondContact O-N 2.9Å; L1402-F1407 WeakPolarHBondContact O-CB 3.49Å; L1402-F1407 PolarHBondContact O-N 3.04Å; L1402-V1414 HydrophobicContact CB-CG1 4.38Å; L1402-E1415 HydrophobicContact CD1-CB 3.68Å; L1402-E1415 HydrophobicContact CD1-CG 4.07Å; L1402-E1415 HydrophobicContact CD2-CB 4.31Å; L1402-E1415 HydrophobicContact CD2-CG 4.11Å; L1402-V1418 HydrophobicContact CD2-CB 4.04Å; L1402-V1418 HydrophobicContact CD2-CG1 4.1Å; L1402-V1418 HydrophobicContact CD2-CG2 4.1Å
1403	L	89.1	Confident	87.7	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-73.6	-28.5	-176.4	-75.6	174.8	0	0	0	114.6	F1399 S1400 F1407 L1504 L1508	F1399-L1403 HydrophobicContact CD2-CD1 4.11Å; F1399-L1403 HydrophobicContact CD2-CG 4.19Å; F1399-L1403 HydrophobicContact CE2-CD1 3.64Å; F1399-L1403 HydrophobicContact CE2-CD2 4.46Å; F1399-L1403 HydrophobicContact CE2-CG 3.88Å; F1399-L1403 HydrophobicContact CZ-CD1 3.99Å; F1399-L1403 PolarHBondContact O-N 3.09Å; F1399-L1403 VanDerWaalsContact O-N 3.07Å; S1400-L1403 PolarHBondContact O-N 3.36Å; L1403-F1407 HydrophobicContact CD2-CD2 4.23Å; L1403-F1407 HydrophobicContact CD2-CE2 4.37Å; L1403-L1504 HydrophobicContact CD1-CB 4.28Å; L1403-L1504 HydrophobicContact CD2-CB 3.77Å; L1403-L1504 HydrophobicContact CD2-CD1 4.23Å; L1403-L1508 HydrophobicContact CD1-CB 4.04Å; L1403-L1508 HydrophobicContact CD1-CD2 3.89Å
1404	L	89.5	Confident	87.6	Confident	137 Å²	137	53 Å²	53	72%	0.717	27%	0.274	S	S	*	.	H	α-helix	trans	-91.1	-36.9	-177.5	-68.7	172.7	0	0	0	113.4	S1400	S1400-L1404 VanDerWaalsContact O-CB 3.29Å; S1400-L1404 WeakPolarHBondContact O-CB 3.35Å; S1400-L1404 WeakPolarHBondContact O-CG 3.5Å; S1400-L1404 PolarHBondContact O-N 2.82Å
1405	V	87	Confident	87.6	Confident	96 Å²	96	50.7 Å²	50.7	58%	0.582	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	-44.6	-167.9	-175.5	0	0	0	0	113.2	Y1401	Y1401-V1405 HydrophobicContact CD2-CB 4.02Å; Y1401-V1405 HydrophobicContact CD2-CG2 3.93Å; Y1401-V1405 HydrophobicContact CE2-CB 3.8Å; Y1401-V1405 HydrophobicContact CE2-CG1 3.82Å; Y1401-V1405 HydrophobicContact CE2-CG2 3.95Å; Y1401-V1405 WeakPolarHBondContact O-CB 3.37Å; Y1401-V1405 PolarHBondContact O-N 2.77Å
1406	D	83.6	Confident	87.4	Confident	23 Å²	23	57.4 Å²	57.4	12%	0.123	29%	0.285	C	S	.	.			trans	-117.1	26.1	-165.6	-151.6	27.3	0	0	0	114.7	Y1401 L1402 R1408 T1412	Y1401-D1406 HydrophobicContact CE1-CB 4.06Å; Y1401-D1406 PolarHBondContact O-N 3.33Å; L1402-D1406 CarbonylContact O-C 3.59Å; L1402-D1406 PolarHBondContact O-N 2.9Å; D1406-R1408 PolarHBondContact O-N 3.4Å; D1406-R1408 VanDerWaalsContact O-N 3.11Å; D1406-R1408 IonicContact OD1-CZ 3.51Å; D1406-R1408 IonicContact OD1-NE 3.79Å; D1406-R1408 PolarHBondContact OD1-NE 3.06Å; D1406-R1408 IonicContact OD1-NH2 2.71Å; D1406-T1412 WeakPolarHBondContact O-CG2 3.2Å; D1406-T1412 WeakPolarHBondContact OD2-CB 3.3Å; D1406-T1412 WeakPolarHBondContact OD2-CG2 3.3Å; D1406-T1412 PolarHBondContact OD2-OG1 3.01Å
1407	F	83.4	Confident	87.3	Confident	28 Å²	28	60.8 Å²	60.8	12%	0.123	30%	0.302	C	S	.	.			trans	-81.2	83.6	175.7	-162.7	-103.9	0	0	0	110.8	L1402 L1403 L1497 R1501 L1504	L1402-F1407 WeakPolarHBondContact O-CB 3.49Å; L1402-F1407 PolarHBondContact O-N 3.04Å; L1403-F1407 HydrophobicContact CD2-CD2 4.23Å; L1403-F1407 HydrophobicContact CD2-CE2 4.37Å; F1407-L1497 HydrophobicContact CE1-CD1 3.91Å; F1407-L1497 HydrophobicContact CE1-CG 4.39Å; F1407-L1497 HydrophobicContact CZ-CD1 4.4Å; F1407-R1501 HydrophobicContact CE1-CB 4.43Å; F1407-L1504 HydrophobicContact CE2-CD1 3.78Å; F1407-L1504 HydrophobicContact CZ-CD1 4.17Å
1408	R	77.9	Confident	87.2	Confident	140 Å²	140	55.9 Å²	55.9	53%	0.528	28%	0.277	S	S	.	.			trans	-97.8	173	-178.1	-58.5	-172	-172.8	-136.2	-1.2	112.1	D1406 N1410 T1412 R1469	D1406-R1408 PolarHBondContact O-N 3.4Å; D1406-R1408 VanDerWaalsContact O-N 3.11Å; D1406-R1408 IonicContact OD1-CZ 3.51Å; D1406-R1408 IonicContact OD1-NE 3.79Å; D1406-R1408 PolarHBondContact OD1-NE 3.06Å; D1406-R1408 IonicContact OD1-NH2 2.71Å; R1408-N1410 VanDerWaalsContact C-N 3.31Å; R1408-N1410 PolarHBondContact O-N 3.49Å; R1408-T1412 HydrophobicContact CB-CG2 4.26Å; R1408-T1412 HydrophobicContact CG-CG2 4.16Å; R1408-R1469 VanDerWaalsContact O-CZ 3.23Å; R1408-R1469 PolarHBondContact O-NH1 3.45Å; R1408-R1469 PolarHBondContact O-NH2 3.17Å
1409	I	74.7	Confident	87.1	Confident	11 Å²	11	54.8 Å²	54.8	6%	0.056	27%	0.271	C	S	.	.	S	Bend	trans	-65.8	-38.3	174.2	-63.8	-172.8	0	0	0	110.7	R1469 L1473 L1476 F1482 E1487 I1491	I1409-R1469 PolarHBondContact O-NH1 3.47Å; I1409-R1469 PolarHBondContact O-NH2 3.3Å; I1409-L1473 VanDerWaalsContact O-CD2 3.24Å; I1409-L1473 WeakPolarHBondContact O-CD2 3.39Å; I1409-L1476 HydrophobicContact CD1-CD1 4.26Å; I1409-L1476 HydrophobicContact CG2-CD1 3.88Å; I1409-F1482 HydrophobicContact CD1-CE1 3.87Å; I1409-E1487 HydrophobicContact CB-CG 4.19Å; I1409-E1487 HydrophobicContact CD1-CB 4.33Å; I1409-E1487 HydrophobicContact CD1-CG 3.57Å; I1409-E1487 HydrophobicContact CG1-CG 3.66Å; I1409-E1487 PolarHBondContact N-OE1 2.94Å; I1409-I1491 HydrophobicContact CD1-CG1 4.29Å; I1409-I1491 HydrophobicContact CG1-CD1 4.25Å; I1409-I1491 HydrophobicContact CG1-CG1 3.93Å
1410	N	76.9	Confident	86.8	Confident	115 Å²	115	56.9 Å²	56.9	62%	0.615	29%	0.289	S	S	*	.	S	Bend	trans	-82.2	148.2	175.5	-63.5	-42.5	0	0	0	112.3	R1408 T1412	R1408-N1410 VanDerWaalsContact C-N 3.31Å; R1408-N1410 PolarHBondContact O-N 3.49Å; N1410-T1412 PolarHBondContact O-N 3.23Å
1411	I	83.2	Confident	86.7	Confident	50 Å²	50	57.5 Å²	57.5	26%	0.256	29%	0.289	S	S	.	.			trans	-68.2	116	175.9	-55.5	177.5	0	0	0	109.8	E1415 Y1416 I1419 L1473	I1411-E1415 WeakPolarHBondContact CA-OE2 3.43Å; I1411-E1415 HydrophobicContact CG2-CB 3.84Å; I1411-E1415 HydrophobicContact CG2-CG 3.94Å; I1411-Y1416 HydrophobicContact CB-CE2 3.97Å; I1411-Y1416 HydrophobicContact CG2-CD1 4.13Å; I1411-Y1416 HydrophobicContact CG2-CD2 3.69Å; I1411-Y1416 HydrophobicContact CG2-CE1 3.98Å; I1411-Y1416 HydrophobicContact CG2-CE2 3.51Å; I1411-Y1416 HydrophobicContact CG2-CG 4Å; I1411-I1419 HydrophobicContact CG2-CD1 4.36Å; I1411-L1473 HydrophobicContact CD1-CD1 3.77Å; I1411-L1473 HydrophobicContact CG1-CD1 3.68Å; I1411-L1473 HydrophobicContact CG1-CD2 4.33Å
1412	T	85.9	Confident	86.6	Confident	17 Å²	17	52.5 Å²	52.5	10%	0.104	27%	0.27	C	S	.	.			trans	-80.6	162.9	179.5	70.4	0	0	0	0	111.9	D1406 R1408 N1410 V1414 E1415 Y1416	D1406-T1412 WeakPolarHBondContact O-CG2 3.2Å; D1406-T1412 WeakPolarHBondContact OD2-CB 3.3Å; D1406-T1412 WeakPolarHBondContact OD2-CG2 3.3Å; D1406-T1412 PolarHBondContact OD2-OG1 3.01Å; R1408-T1412 HydrophobicContact CB-CG2 4.26Å; R1408-T1412 HydrophobicContact CG-CG2 4.16Å; N1410-T1412 PolarHBondContact O-N 3.23Å; T1412-V1414 PolarHBondContact O-N 2.83Å; T1412-E1415 WeakPolarHBondContact O-CA 3.42Å; T1412-E1415 WeakPolarHBondContact O-CB 3.29Å; T1412-E1415 PolarHBondContact O-N 3.4Å; T1412-E1415 PolarHBondContact OG1-N 3.33Å; T1412-E1415 VanDerWaalsContact OG1-N 3.15Å; T1412-Y1416 VanDerWaalsContact O-CD2 3.26Å; T1412-Y1416 WeakPolarHBondContact O-CD2 3.44Å; T1412-Y1416 PolarHBondContact O-N 3.12Å
1413	V	87.8	Confident	86.4	Confident	112 Å²	112	56.5 Å²	56.5	68%	0.679	29%	0.29	S	S	*	.	H	α-helix	trans	-59.7	-35.7	175.7	-179.3	0	0	0	0	110.8	Y1416 I1417	V1413-Y1416 PolarHBondContact O-N 3.13Å; V1413-I1417 HydrophobicContact CG1-CD1 4.36Å; V1413-I1417 WeakPolarHBondContact O-CG1 3.4Å; V1413-I1417 PolarHBondContact O-N 3.25Å; V1413-I1417 VanDerWaalsContact O-N 3.12Å
1414	V	90.3	Very high	86.3	Confident	29 Å²	29	56.2 Å²	56.2	18%	0.176	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-41.6	174.6	-175.7	0	0	0	0	110.7	L1398 Y1401 L1402 T1412 Y1416 I1417 V1418	L1398-V1414 HydrophobicContact CD2-CG1 4.44Å; Y1401-V1414 HydrophobicContact CD1-CG1 4.22Å; Y1401-V1414 HydrophobicContact CD1-CG2 4.45Å; Y1401-V1414 HydrophobicContact CE1-CG2 4.22Å; L1402-V1414 HydrophobicContact CB-CG1 4.38Å; T1412-V1414 PolarHBondContact O-N 2.83Å; V1414-Y1416 VanDerWaalsContact C-N 3.35Å; V1414-Y1416 PolarHBondContact O-N 3.48Å; V1414-I1417 PolarHBondContact O-N 2.91Å; V1414-I1417 VanDerWaalsContact O-N 3.15Å; V1414-V1418 HydrophobicContact CG1-CG2 4.44Å; V1414-V1418 WeakPolarHBondContact O-CG2 3.26Å; V1414-V1418 PolarHBondContact O-N 3.27Å
1415	E	89.8	Confident	86.2	Confident	7 Å²	7	50.7 Å²	50.7	3%	0.033	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-43.3	175.3	-164.1	168.8	-178.6	0	0	111.2	L1402 I1411 T1412 I1417 V1418 I1419 R1469	L1402-E1415 HydrophobicContact CD1-CB 3.68Å; L1402-E1415 HydrophobicContact CD1-CG 4.07Å; L1402-E1415 HydrophobicContact CD2-CB 4.31Å; L1402-E1415 HydrophobicContact CD2-CG 4.11Å; I1411-E1415 WeakPolarHBondContact CA-OE2 3.43Å; I1411-E1415 HydrophobicContact CG2-CB 3.84Å; I1411-E1415 HydrophobicContact CG2-CG 3.94Å; T1412-E1415 WeakPolarHBondContact O-CA 3.42Å; T1412-E1415 WeakPolarHBondContact O-CB 3.29Å; T1412-E1415 PolarHBondContact O-N 3.4Å; T1412-E1415 PolarHBondContact OG1-N 3.33Å; T1412-E1415 VanDerWaalsContact OG1-N 3.15Å; E1415-I1417 VanDerWaalsContact C-N 3.32Å; E1415-I1417 PolarHBondContact O-N 3.34Å; E1415-V1418 PolarHBondContact O-N 2.9Å; E1415-I1419 HydrophobicContact CG-CD1 3.88Å; E1415-I1419 HydrophobicContact CG-CG1 4.44Å; E1415-I1419 WeakPolarHBondContact O-CB 3.29Å; E1415-I1419 WeakPolarHBondContact O-CD1 3.25Å; E1415-I1419 WeakPolarHBondContact O-CG1 3.29Å; E1415-I1419 PolarHBondContact O-N 3.13Å; E1415-R1469 IonicContact OE1-CZ 3.75Å; E1415-R1469 IonicContact OE1-NE 2.84Å; E1415-R1469 PolarHBondContact OE1-NE 3.07Å; E1415-R1469 IonicContact OE1-NH2 3.38Å; E1415-R1469 PolarHBondContact OE1-NH2 3.29Å; E1415-R1469 IonicContact OE2-NH2 3.53Å; E1415-R1469 PolarHBondContact OE2-NH2 3.11Å; E1415-R1469 VanDerWaalsContact OE2-NH2 3.17Å
1416	Y	88.8	Confident	86.2	Confident	142 Å²	142	50.3 Å²	50.3	56%	0.557	25%	0.251	S	S	*	.	H	α-helix	trans	-58.8	-40.7	173.2	-79.6	-67.4	0	0	0	113.1	I1411 T1412 V1413 V1414 A1420	I1411-Y1416 HydrophobicContact CB-CE2 3.97Å; I1411-Y1416 HydrophobicContact CG2-CD1 4.13Å; I1411-Y1416 HydrophobicContact CG2-CD2 3.69Å; I1411-Y1416 HydrophobicContact CG2-CE1 3.98Å; I1411-Y1416 HydrophobicContact CG2-CE2 3.51Å; I1411-Y1416 HydrophobicContact CG2-CG 4Å; T1412-Y1416 VanDerWaalsContact O-CD2 3.26Å; T1412-Y1416 WeakPolarHBondContact O-CD2 3.44Å; T1412-Y1416 PolarHBondContact O-N 3.12Å; V1413-Y1416 PolarHBondContact O-N 3.13Å; V1414-Y1416 VanDerWaalsContact C-N 3.35Å; V1414-Y1416 PolarHBondContact O-N 3.48Å; Y1416-A1420 VanDerWaalsContact O-CB 3.29Å; Y1416-A1420 WeakPolarHBondContact O-CB 3.23Å; Y1416-A1420 PolarHBondContact O-N 3.43Å
1417	I	90.3	Very high	86.2	Confident	75 Å²	75	51.9 Å²	51.9	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-66.1	-45.4	177.8	-67.2	165.9	0	0	0	110.5	L1398 V1413 V1414 E1415 A1420 W1421	L1398-I1417 HydrophobicContact CD1-CG2 4.31Å; V1413-I1417 HydrophobicContact CG1-CD1 4.36Å; V1413-I1417 WeakPolarHBondContact O-CG1 3.4Å; V1413-I1417 PolarHBondContact O-N 3.25Å; V1413-I1417 VanDerWaalsContact O-N 3.12Å; V1414-I1417 PolarHBondContact O-N 2.91Å; V1414-I1417 VanDerWaalsContact O-N 3.15Å; E1415-I1417 VanDerWaalsContact C-N 3.32Å; E1415-I1417 PolarHBondContact O-N 3.34Å; I1417-A1420 PolarHBondContact O-N 3.4Å; I1417-W1421 HydrophobicContact CG2-CE3 3.96Å; I1417-W1421 HydrophobicContact CG2-CZ3 4.25Å; I1417-W1421 WeakPolarHBondContact O-CB 3.36Å; I1417-W1421 PolarHBondContact O-N 3.24Å
1418	V	90.8	Very high	86.2	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-44	178.8	174.2	0	0	0	0	110.8	F1395 L1398 F1399 L1402 V1414 E1415 A1420 W1421 V1422 Y1462	F1395-V1418 HydrophobicContact CE2-CG1 4.25Å; L1398-V1418 HydrophobicContact CB-CG2 4.22Å; F1399-V1418 HydrophobicContact CB-CG1 4.3Å; F1399-V1418 HydrophobicContact CD2-CG1 3.95Å; F1399-V1418 HydrophobicContact CG-CG1 4.17Å; L1402-V1418 HydrophobicContact CD2-CB 4.04Å; L1402-V1418 HydrophobicContact CD2-CG1 4.1Å; L1402-V1418 HydrophobicContact CD2-CG2 4.1Å; V1414-V1418 HydrophobicContact CG1-CG2 4.44Å; V1414-V1418 WeakPolarHBondContact O-CG2 3.26Å; V1414-V1418 PolarHBondContact O-N 3.27Å; E1415-V1418 PolarHBondContact O-N 2.9Å; V1418-A1420 PolarHBondContact O-N 3.47Å; V1418-W1421 WeakPolarHBondContact O-CA 3.26Å; V1418-W1421 WeakPolarHBondContact O-CB 3.42Å; V1418-W1421 PolarHBondContact O-N 3.47Å; V1418-W1421 VanDerWaalsContact O-N 3.11Å; V1418-V1422 HydrophobicContact CG1-CG2 4.4Å; V1418-V1422 WeakPolarHBondContact O-CG2 3.31Å; V1418-V1422 PolarHBondContact O-N 3.07Å; V1418-Y1462 HydrophobicContact CG1-CE2 4.5Å
1419	I	89.1	Confident	86.4	Confident	24 Å²	24	45.1 Å²	45.1	12%	0.123	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-48.8	175	-69.4	162.6	0	0	0	110.1	I1411 E1415 W1421 V1422 I1423 F1466	I1411-I1419 HydrophobicContact CG2-CD1 4.36Å; E1415-I1419 HydrophobicContact CG-CD1 3.88Å; E1415-I1419 HydrophobicContact CG-CG1 4.44Å; E1415-I1419 WeakPolarHBondContact O-CB 3.29Å; E1415-I1419 WeakPolarHBondContact O-CD1 3.25Å; E1415-I1419 WeakPolarHBondContact O-CG1 3.29Å; E1415-I1419 PolarHBondContact O-N 3.13Å; I1419-W1421 PolarHBondContact O-N 2.91Å; I1419-V1422 PolarHBondContact O-N 2.99Å; I1419-I1423 HydrophobicContact CG2-CD1 3.78Å; I1419-I1423 HydrophobicContact CG2-CG1 4.45Å; I1419-I1423 WeakPolarHBondContact O-CB 3.39Å; I1419-I1423 VanDerWaalsContact O-CG1 3.26Å; I1419-I1423 WeakPolarHBondContact O-CG1 3.49Å; I1419-I1423 PolarHBondContact O-N 3.4Å; I1419-F1466 HydrophobicContact CD1-CD2 4.41Å; I1419-F1466 HydrophobicContact CD1-CE2 3.62Å; I1419-F1466 HydrophobicContact CD1-CZ 4.42Å; I1419-F1466 HydrophobicContact CG1-CD2 4.37Å; I1419-F1466 HydrophobicContact CG1-CE2 3.94Å
1420	A	88.3	Confident	86.7	Confident	45 Å²	45	48.4 Å²	48.4	37%	0.372	25%	0.25	S	C	.	.	H	α-helix	trans	-58.9	-38.8	176.5	0	0	0	0	0	111.5	Y1416 I1417 V1418 T1424	Y1416-A1420 VanDerWaalsContact O-CB 3.29Å; Y1416-A1420 WeakPolarHBondContact O-CB 3.23Å; Y1416-A1420 PolarHBondContact O-N 3.43Å; I1417-A1420 PolarHBondContact O-N 3.4Å; V1418-A1420 PolarHBondContact O-N 3.47Å; A1420-T1424 WeakPolarHBondContact O-CG2 3.39Å; A1420-T1424 PolarHBondContact O-N 3.25Å
1421	W	90.9	Very high	86.7	Confident	29 Å²	29	45.4 Å²	45.4	11%	0.11	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-46.7	176.9	-139.9	-65.2	0	0	0	112.6	S1391 F1395 L1398 I1417 V1418 I1419 I1423 T1424 L1425 P1686 P1687	S1391-W1421 WeakPolarHBondContact O-CZ2 3.48Å; F1395-W1421 HydrophobicContact CB-CD2 4.41Å; F1395-W1421 HydrophobicContact CB-CG 4.45Å; F1395-W1421 HydrophobicContact CB-CZ2 4.5Å; F1395-W1421 HydrophobicContact CD2-CB 3.97Å; F1395-W1421 AromaticContact CD2-CD1 3.82Å; F1395-W1421 HydrophobicContact CD2-CD2 4.46Å; F1395-W1421 AromaticContact CD2-CG 3.83Å; F1395-W1421 HydrophobicContact CD2-CG 3.83Å; F1395-W1421 HydrophobicContact CE2-CB 4.36Å; F1395-W1421 HydrophobicContact CG-CG 4.47Å; L1398-W1421 HydrophobicContact CD1-CZ3 4.25Å; I1417-W1421 HydrophobicContact CG2-CE3 3.96Å; I1417-W1421 HydrophobicContact CG2-CZ3 4.25Å; I1417-W1421 WeakPolarHBondContact O-CB 3.36Å; I1417-W1421 PolarHBondContact O-N 3.24Å; V1418-W1421 WeakPolarHBondContact O-CA 3.26Å; V1418-W1421 WeakPolarHBondContact O-CB 3.42Å; V1418-W1421 PolarHBondContact O-N 3.47Å; V1418-W1421 VanDerWaalsContact O-N 3.11Å; I1419-W1421 PolarHBondContact O-N 2.91Å; W1421-I1423 VanDerWaalsContact C-N 3.3Å; W1421-I1423 PolarHBondContact O-N 3.28Å; W1421-T1424 WeakPolarHBondContact CA-OG1 3.42Å; W1421-T1424 WeakPolarHBondContact O-CA 3.34Å; W1421-T1424 PolarHBondContact O-N 2.66Å; W1421-T1424 PolarHBondContact O-OG1 3.06Å; W1421-L1425 PolarHBondContact O-N 2.99Å; W1421-P1686 WeakPolarHBondContact CZ2-O 2.94Å; W1421-P1687 HydrophobicContact CD2-CB 4.42Å; W1421-P1687 HydrophobicContact CD2-CG 4.25Å; W1421-P1687 HydrophobicContact CE3-CG 3.99Å; W1421-P1687 HydrophobicContact CZ3-CG 4.18Å
1422	V	90.2	Very high	86.2	Confident	7 Å²	7	43.7 Å²	43.7	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-37.1	178.2	177.7	0	0	0	0	110.8	F1395 V1418 I1419 T1424 L1425 F1426 L1459 Y1462	F1395-V1422 HydrophobicContact CE2-CG2 3.73Å; F1395-V1422 HydrophobicContact CZ-CG2 3.97Å; V1418-V1422 HydrophobicContact CG1-CG2 4.4Å; V1418-V1422 WeakPolarHBondContact O-CG2 3.31Å; V1418-V1422 PolarHBondContact O-N 3.07Å; I1419-V1422 PolarHBondContact O-N 2.99Å; V1422-T1424 VanDerWaalsContact C-N 3.29Å; V1422-T1424 PolarHBondContact O-N 3.25Å; V1422-L1425 PolarHBondContact O-N 3.05Å; V1422-F1426 VanDerWaalsContact O-CB 3.32Å; V1422-F1426 WeakPolarHBondContact O-CB 3.19Å; V1422-F1426 PolarHBondContact O-N 3.47Å; V1422-L1459 HydrophobicContact CG1-CD2 3.97Å; V1422-Y1462 HydrophobicContact CB-CD1 4.2Å; V1422-Y1462 HydrophobicContact CB-CE1 3.81Å; V1422-Y1462 HydrophobicContact CG1-CD1 3.51Å; V1422-Y1462 HydrophobicContact CG1-CE1 3.63Å; V1422-Y1462 HydrophobicContact CG1-CG 3.98Å; V1422-Y1462 HydrophobicContact CG2-CD1 4.35Å; V1422-Y1462 HydrophobicContact CG2-CD2 4.14Å; V1422-Y1462 HydrophobicContact CG2-CE1 3.97Å; V1422-Y1462 HydrophobicContact CG2-CE2 3.77Å; V1422-Y1462 HydrophobicContact CG2-CG 4.41Å
1423	I	87.9	Confident	85.7	Confident	88 Å²	88	45 Å²	45	45%	0.451	23%	0.228	S	C	.	.	H	α-helix	trans	-58.8	-42.4	171.1	-69.7	167.2	0	0	0	110.6	I1419 W1421 F1426 I1427	I1419-I1423 HydrophobicContact CG2-CD1 3.78Å; I1419-I1423 HydrophobicContact CG2-CG1 4.45Å; I1419-I1423 WeakPolarHBondContact O-CB 3.39Å; I1419-I1423 VanDerWaalsContact O-CG1 3.26Å; I1419-I1423 WeakPolarHBondContact O-CG1 3.49Å; I1419-I1423 PolarHBondContact O-N 3.4Å; W1421-I1423 VanDerWaalsContact C-N 3.3Å; W1421-I1423 PolarHBondContact O-N 3.28Å; I1423-F1426 PolarHBondContact O-N 2.79Å; I1423-I1427 HydrophobicContact CG2-CD1 3.85Å; I1423-I1427 HydrophobicContact CG2-CG1 4.48Å; I1423-I1427 VanDerWaalsContact O-CG1 3.27Å; I1423-I1427 WeakPolarHBondContact O-CG1 3.3Å; I1423-I1427 PolarHBondContact O-N 2.78Å
1424	T	87	Confident	84.9	Confident	5 Å²	5	41.7 Å²	41.7	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-68.5	-35.4	177	59	0	0	0	0	113.6	A1420 W1421 V1422 E1428 P1687 I1689 I1690	A1420-T1424 WeakPolarHBondContact O-CG2 3.39Å; A1420-T1424 PolarHBondContact O-N 3.25Å; W1421-T1424 WeakPolarHBondContact CA-OG1 3.42Å; W1421-T1424 WeakPolarHBondContact O-CA 3.34Å; W1421-T1424 PolarHBondContact O-N 2.66Å; W1421-T1424 PolarHBondContact O-OG1 3.06Å; V1422-T1424 VanDerWaalsContact C-N 3.29Å; V1422-T1424 PolarHBondContact O-N 3.25Å; T1424-E1428 WeakPolarHBondContact O-CB 3.4Å; T1424-E1428 PolarHBondContact O-N 2.86Å; T1424-P1687 HydrophobicContact CG2-CB 3.85Å; T1424-I1689 HydrophobicContact CG2-CG2 4.21Å; T1424-I1690 HydrophobicContact CG2-CB 4.3Å
1425	L	85.9	Confident	83.8	Confident	20 Å²	20	42.9 Å²	42.9	11%	0.105	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-42.7	172.5	-69.1	175.6	0	0	0	111.2	F1395 W1421 V1422 I1427 E1428 E1429 P1686	F1395-L1425 HydrophobicContact CD1-CD1 4.42Å; F1395-L1425 HydrophobicContact CE1-CD1 4.12Å; F1395-L1425 HydrophobicContact CE2-CD1 4.41Å; F1395-L1425 HydrophobicContact CZ-CD1 4.12Å; W1421-L1425 PolarHBondContact O-N 2.99Å; V1422-L1425 PolarHBondContact O-N 3.05Å; L1425-I1427 PolarHBondContact O-N 3.27Å; L1425-E1428 PolarHBondContact O-N 2.96Å; L1425-E1429 PolarHBondContact O-N 3.4Å; L1425-P1686 HydrophobicContact CD2-CG 4.23Å
1426	F	87.1	Confident	82.6	Confident	89 Å²	89	43.4 Å²	43.4	39%	0.39	22%	0.22	S	C	.	.	H	α-helix	trans	-61.8	-43.3	176.2	-176.9	-114.3	0	0	0	111.9	V1422 I1423 E1428 E1429 I1430 L1459 I1463	V1422-F1426 VanDerWaalsContact O-CB 3.32Å; V1422-F1426 WeakPolarHBondContact O-CB 3.19Å; V1422-F1426 PolarHBondContact O-N 3.47Å; I1423-F1426 PolarHBondContact O-N 2.79Å; F1426-E1428 VanDerWaalsContact C-N 3.34Å; F1426-E1428 PolarHBondContact O-N 3.48Å; F1426-E1429 PolarHBondContact O-N 2.96Å; F1426-I1430 HydrophobicContact CD1-CD1 3.65Å; F1426-I1430 HydrophobicContact CD2-CD1 4.5Å; F1426-I1430 HydrophobicContact CE1-CD1 3.25Å; F1426-I1430 HydrophobicContact CE1-CG1 4.32Å; F1426-I1430 HydrophobicContact CE2-CD1 4.16Å; F1426-I1430 HydrophobicContact CE2-CG1 4.45Å; F1426-I1430 HydrophobicContact CG-CD1 4.28Å; F1426-I1430 HydrophobicContact CZ-CD1 3.54Å; F1426-I1430 HydrophobicContact CZ-CG1 4.27Å; F1426-I1430 WeakPolarHBondContact O-CB 3.43Å; F1426-I1430 WeakPolarHBondContact O-CG1 3.34Å; F1426-I1430 PolarHBondContact O-N 2.8Å; F1426-L1459 HydrophobicContact CB-CD2 4.41Å; F1426-L1459 HydrophobicContact CD2-CD1 4.4Å; F1426-I1463 HydrophobicContact CE2-CD1 4.29Å
1427	I	84.8	Confident	81.5	Confident	56 Å²	56	40.3 Å²	40.3	29%	0.287	22%	0.216	S	C	.	.	H	α-helix	trans	-64	-39.7	174.7	-68.5	166.7	0	0	0	111.1	I1423 L1425 I1430 K1431 I1690	I1423-I1427 HydrophobicContact CG2-CD1 3.85Å; I1423-I1427 HydrophobicContact CG2-CG1 4.48Å; I1423-I1427 VanDerWaalsContact O-CG1 3.27Å; I1423-I1427 WeakPolarHBondContact O-CG1 3.3Å; I1423-I1427 PolarHBondContact O-N 2.78Å; L1425-I1427 PolarHBondContact O-N 3.27Å; I1427-I1430 PolarHBondContact O-N 2.83Å; I1427-K1431 WeakPolarHBondContact O-CB 3.46Å; I1427-K1431 PolarHBondContact O-N 3.03Å; I1427-I1690 HydrophobicContact CD1-CD1 4.33Å
1428	E	82	Confident	80.1	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.019	23%	0.228	C	C	.	.	H	α-helix	trans	-65.3	-40	177.1	-178	65.9	179.5	0	0	111.6	T1424 L1425 F1426 K1431 Q1432 R1681 I1689 H1693	T1424-E1428 WeakPolarHBondContact O-CB 3.4Å; T1424-E1428 PolarHBondContact O-N 2.86Å; L1425-E1428 PolarHBondContact O-N 2.96Å; F1426-E1428 VanDerWaalsContact C-N 3.34Å; F1426-E1428 PolarHBondContact O-N 3.48Å; E1428-K1431 WeakPolarHBondContact O-CB 3.42Å; E1428-K1431 PolarHBondContact O-N 2.83Å; E1428-K1431 IonicContact OE1-NZ 3.59Å; E1428-K1431 PolarHBondContact OE1-NZ 2.79Å; E1428-K1431 VanDerWaalsContact OE2-CE 3.28Å; E1428-K1431 WeakPolarHBondContact OE2-CE 3.38Å; E1428-K1431 IonicContact OE2-NZ 2.68Å; E1428-K1431 PolarHBondContact OE2-NZ 3.07Å; E1428-Q1432 WeakPolarHBondContact O-CG 3.42Å; E1428-Q1432 PolarHBondContact O-N 3.13Å; E1428-R1681 IonicContact OE1-NE 2.73Å; E1428-I1689 HydrophobicContact CB-CD1 4.45Å; E1428-I1689 HydrophobicContact CG-CD1 4.26Å; E1428-I1689 WeakPolarHBondContact OE2-CD1 3.42Å; E1428-H1693 IonicContact OE2-CE1 3.84Å; E1428-H1693 PolarHBondContact OE2-CE1 3.3Å; E1428-H1693 IonicContact OE2-NE2 3.63Å; E1428-H1693 PolarHBondContact OE2-NE2 3.36Å
1429	E	83.2	Confident	78.3	Confident	21 Å²	21	44 Å²	44	10%	0.098	24%	0.237	C	C	.	.	H	α-helix	trans	-68.1	-40.5	174	-68.6	-47.7	132.8	0	0	112	L1425 F1426 K1431 Q1432 I1433 Y1446 L1459	L1425-E1429 PolarHBondContact O-N 3.4Å; F1426-E1429 PolarHBondContact O-N 2.96Å; E1429-K1431 VanDerWaalsContact C-N 3.29Å; E1429-K1431 PolarHBondContact O-N 2.95Å; E1429-Q1432 PolarHBondContact O-N 3.44Å; E1429-Q1432 PolarHBondContact OE1-NE2 3.48Å; E1429-Q1432 PolarHBondContact OE2-NE2 2.7Å; E1429-I1433 VanDerWaalsContact O-CG1 3.3Å; E1429-I1433 WeakPolarHBondContact O-CG1 3.27Å; E1429-I1433 PolarHBondContact O-N 3.27Å; E1429-Y1446 PolarHBondContact OE2-OH 3.48Å; E1429-L1459 HydrophobicContact CB-CD1 4.27Å; E1429-L1459 HydrophobicContact CG-CD1 3.9Å
1430	I	80.3	Confident	76.5	Confident	80 Å²	80	45.8 Å²	45.8	41%	0.41	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-41.5	170.8	-72.8	172.2	0	0	0	110.5	F1426 I1427 Q1432 I1433 A1434	F1426-I1430 HydrophobicContact CD1-CD1 3.65Å; F1426-I1430 HydrophobicContact CD2-CD1 4.5Å; F1426-I1430 HydrophobicContact CE1-CD1 3.25Å; F1426-I1430 HydrophobicContact CE1-CG1 4.32Å; F1426-I1430 HydrophobicContact CE2-CD1 4.16Å; F1426-I1430 HydrophobicContact CE2-CG1 4.45Å; F1426-I1430 HydrophobicContact CG-CD1 4.28Å; F1426-I1430 HydrophobicContact CZ-CD1 3.54Å; F1426-I1430 HydrophobicContact CZ-CG1 4.27Å; F1426-I1430 WeakPolarHBondContact O-CB 3.43Å; F1426-I1430 WeakPolarHBondContact O-CG1 3.34Å; F1426-I1430 PolarHBondContact O-N 2.8Å; I1427-I1430 PolarHBondContact O-N 2.83Å; I1430-Q1432 VanDerWaalsContact C-N 3.34Å; I1430-Q1432 PolarHBondContact O-N 2.98Å; I1430-I1433 PolarHBondContact O-N 3.16Å; I1430-A1434 WeakPolarHBondContact O-CB 3.38Å; I1430-A1434 PolarHBondContact O-N 3.42Å
1431	K	76.5	Confident	75	Confident	53 Å²	53	45 Å²	45	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-42	177.4	-170.5	-160	77.1	-167.8	0	110.7	I1427 E1428 E1429 A1434 W1435 S1682	I1427-K1431 WeakPolarHBondContact O-CB 3.46Å; I1427-K1431 PolarHBondContact O-N 3.03Å; E1428-K1431 WeakPolarHBondContact O-CB 3.42Å; E1428-K1431 PolarHBondContact O-N 2.83Å; E1428-K1431 IonicContact OE1-NZ 3.59Å; E1428-K1431 PolarHBondContact OE1-NZ 2.79Å; E1428-K1431 VanDerWaalsContact OE2-CE 3.28Å; E1428-K1431 WeakPolarHBondContact OE2-CE 3.38Å; E1428-K1431 IonicContact OE2-NZ 2.68Å; E1428-K1431 PolarHBondContact OE2-NZ 3.07Å; E1429-K1431 VanDerWaalsContact C-N 3.29Å; E1429-K1431 PolarHBondContact O-N 2.95Å; K1431-A1434 PolarHBondContact O-N 3.34Å; K1431-W1435 WeakPolarHBondContact O-CB 3.11Å; K1431-W1435 PolarHBondContact O-N 3.35Å; K1431-S1682 PolarHBondContact NZ-OG 2.96Å
1432	Q	74.4	Confident	73.4	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.065	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-45.1	175.7	-72.3	179	60.3	0	0	111.9	E1428 E1429 I1430 W1435 A1436 Y1446	E1428-Q1432 WeakPolarHBondContact O-CG 3.42Å; E1428-Q1432 PolarHBondContact O-N 3.13Å; E1429-Q1432 PolarHBondContact O-N 3.44Å; E1429-Q1432 PolarHBondContact OE1-NE2 3.48Å; E1429-Q1432 PolarHBondContact OE2-NE2 2.7Å; I1430-Q1432 VanDerWaalsContact C-N 3.34Å; I1430-Q1432 PolarHBondContact O-N 2.98Å; Q1432-W1435 PolarHBondContact O-N 3.07Å; Q1432-A1436 WeakPolarHBondContact O-CB 3.38Å; Q1432-A1436 PolarHBondContact O-N 3.3Å; Q1432-Y1446 HydrophobicContact CB-CE2 4.44Å
1433	I	74.9	Confident	72.3	Confident	44 Å²	44	52 Å²	52	23%	0.226	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-47	176.1	-66.6	165.7	0	0	0	110.3	E1429 I1430 W1435 A1436 V1437 F1443 Y1446	E1429-I1433 VanDerWaalsContact O-CG1 3.3Å; E1429-I1433 WeakPolarHBondContact O-CG1 3.27Å; E1429-I1433 PolarHBondContact O-N 3.27Å; I1430-I1433 PolarHBondContact O-N 3.16Å; I1433-W1435 VanDerWaalsContact C-N 3.3Å; I1433-W1435 PolarHBondContact O-N 3.25Å; I1433-A1436 PolarHBondContact O-N 3.38Å; I1433-V1437 HydrophobicContact CG2-CG2 4.07Å; I1433-V1437 WeakPolarHBondContact O-CB 3.17Å; I1433-V1437 VanDerWaalsContact O-CG2 3.23Å; I1433-V1437 WeakPolarHBondContact O-CG2 3.01Å; I1433-V1437 PolarHBondContact O-N 2.79Å; I1433-F1443 HydrophobicContact CG2-CD2 4.33Å; I1433-F1443 HydrophobicContact CG2-CE2 4.4Å; I1433-Y1446 HydrophobicContact CD1-CE1 3.88Å; I1433-Y1446 HydrophobicContact CG1-CD1 4Å; I1433-Y1446 HydrophobicContact CG1-CE1 3.57Å; I1433-Y1446 HydrophobicContact CG1-CE2 4.16Å; I1433-Y1446 HydrophobicContact CG1-CG 4.46Å
1434	A	71.3	Confident	71.4	Confident	43 Å²	43	53.2 Å²	53.2	36%	0.355	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-41.3	178.8	0	0	0	0	0	110.9	I1430 K1431 L1438	I1430-A1434 WeakPolarHBondContact O-CB 3.38Å; I1430-A1434 PolarHBondContact O-N 3.42Å; K1431-A1434 PolarHBondContact O-N 3.34Å; A1434-L1438 VanDerWaalsContact O-CB 3.24Å; A1434-L1438 WeakPolarHBondContact O-CB 3.47Å; A1434-L1438 WeakPolarHBondContact O-CD1 3.41Å; A1434-L1438 PolarHBondContact O-N 3.37Å
1435	W	67.1	Low	70.4	Confident	53 Å²	53	54.9 Å²	54.9	20%	0.201	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-42.5	174.5	-179.2	59.3	0	0	0	111.7	H991 R993 K1431 Q1432 I1433 S1439 H1680	H991-W1435 HydrophobicContact CB-CZ2 3.75Å; R993-W1435 HydrophobicContact CB-CH2 4.36Å; R993-W1435 HydrophobicContact CB-CZ3 3.96Å; K1431-W1435 WeakPolarHBondContact O-CB 3.11Å; K1431-W1435 PolarHBondContact O-N 3.35Å; Q1432-W1435 PolarHBondContact O-N 3.07Å; I1433-W1435 VanDerWaalsContact C-N 3.3Å; I1433-W1435 PolarHBondContact O-N 3.25Å; W1435-S1439 VanDerWaalsContact O-CB 3.22Å; W1435-S1439 WeakPolarHBondContact O-CB 3.37Å; W1435-S1439 PolarHBondContact O-N 3.03Å; W1435-S1439 PolarHBondContact O-OG 3.15Å; W1435-H1680 HydrophobicContact CH2-CB 3.9Å; W1435-H1680 AromaticContact CH2-CD2 3.81Å; W1435-H1680 HydrophobicContact CZ2-CB 4.14Å; W1435-H1680 AromaticContact CZ2-CD2 3.79Å
1436	A	64.1	Low	69.6	Low	18 Å²	18	55 Å²	55	15%	0.149	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-44.5	175.2	0	0	0	0	0	112.3	Q1432 I1433 S1439 G1440	Q1432-A1436 WeakPolarHBondContact O-CB 3.38Å; Q1432-A1436 PolarHBondContact O-N 3.3Å; I1433-A1436 PolarHBondContact O-N 3.38Å; A1436-S1439 PolarHBondContact O-N 3.31Å; A1436-G1440 PolarHBondContact O-N 2.98Å
1437	V	65.9	Low	69	Low	78 Å²	78	53.9 Å²	53.9	47%	0.473	30%	0.297	S	S	.	.	H	α-helix	trans	-70.1	-43.7	179.6	173.8	0	0	0	0	111.2	I1433 S1439 G1440	I1433-V1437 HydrophobicContact CG2-CG2 4.07Å; I1433-V1437 WeakPolarHBondContact O-CB 3.17Å; I1433-V1437 VanDerWaalsContact O-CG2 3.23Å; I1433-V1437 WeakPolarHBondContact O-CG2 3.01Å; I1433-V1437 PolarHBondContact O-N 2.79Å; V1437-S1439 PolarHBondContact O-N 3.5Å; V1437-G1440 PolarHBondContact O-N 3.22Å; V1437-G1440 VanDerWaalsContact O-N 3.09Å
1438	L	60.7	Low	68.5	Low	125 Å²	125	53.6 Å²	53.6	65%	0.654	30%	0.3	S	S	*	.	H	α-helix	trans	-62.7	-28.7	173.2	-104.4	76.8	0	0	0	112.1	L987 A1434 G1440	L987-L1438 HydrophobicContact CD2-CD2 3.73Å; A1434-L1438 VanDerWaalsContact O-CB 3.24Å; A1434-L1438 WeakPolarHBondContact O-CB 3.47Å; A1434-L1438 WeakPolarHBondContact O-CD1 3.41Å; A1434-L1438 PolarHBondContact O-N 3.37Å; L1438-G1440 VanDerWaalsContact C-N 3.27Å
1439	S	53.5	Low	68.1	Low	27 Å²	27	54.8 Å²	54.8	19%	0.189	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-9.3	178.7	-55.3	0	0	0	0	112.7	H991 F992 W1435 A1436 V1437	H991-S1439 PolarHBondContact O-OG 3.35Å; F992-S1439 WeakPolarHBondContact CE2-O 3.48Å; F992-S1439 WeakPolarHBondContact CZ-O 3.32Å; W1435-S1439 VanDerWaalsContact O-CB 3.22Å; W1435-S1439 WeakPolarHBondContact O-CB 3.37Å; W1435-S1439 PolarHBondContact O-N 3.03Å; W1435-S1439 PolarHBondContact O-OG 3.15Å; A1436-S1439 PolarHBondContact O-N 3.31Å; V1437-S1439 PolarHBondContact O-N 3.5Å
1440	G	50.8	Low	67.8	Low	62 Å²	62	56.1 Å²	56.1	64%	0.639	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	7.3	164.7	0	0	0	0	0	116.8	A1436 V1437 L1438	A1436-G1440 PolarHBondContact O-N 2.98Å; V1437-G1440 PolarHBondContact O-N 3.22Å; V1437-G1440 VanDerWaalsContact O-N 3.09Å; L1438-G1440 VanDerWaalsContact C-N 3.27Å
1441	I	56.3	Low	68	Low	29 Å²	29	55.2 Å²	55.2	15%	0.149	32%	0.317	C	S	.	.	S	Bend	trans	-107.6	138.4	173.6	-66.7	168.4	0	0	0	109.3	D658 F992 I994 T1445	D658-I1441 HydrophobicContact CB-CD1 3.77Å; D658-I1441 HydrophobicContact CB-CG1 4.41Å; F992-I1441 HydrophobicContact CE1-CB 3.76Å; F992-I1441 HydrophobicContact CE1-CD1 3.96Å; F992-I1441 HydrophobicContact CE1-CG1 4.08Å; F992-I1441 HydrophobicContact CE2-CD1 3.76Å; F992-I1441 HydrophobicContact CE2-CG1 4.16Å; F992-I1441 HydrophobicContact CZ-CB 3.62Å; F992-I1441 HydrophobicContact CZ-CD1 3.43Å; F992-I1441 VanDerWaalsContact CZ-CD1 3.43Å; F992-I1441 HydrophobicContact CZ-CG1 3.46Å; F992-I1441 VanDerWaalsContact CZ-CG1 3.46Å; I994-I1441 HydrophobicContact CD1-CB 4.45Å; I994-I1441 HydrophobicContact CD1-CD1 3.64Å; I994-I1441 HydrophobicContact CD1-CG2 3.91Å; I1441-T1445 HydrophobicContact CG2-CG2 4.36Å; I1441-T1445 WeakPolarHBondContact CG2-OG1 3.49Å
1442	S	58.3	Low	68.3	Low	73 Å²	73	53.3 Å²	53.3	51%	0.51	31%	0.309	S	S	.	.			trans	-51.8	141.6	-161.9	-170.9	0	0	0	0	113.6	R1444 T1445	S1442-R1444 PolarHBondContact O-N 3.4Å; S1442-R1444 WeakPolarHBondContact OG-CB 3.17Å; S1442-R1444 PolarHBondContact OG-N 2.95Å; S1442-T1445 WeakPolarHBondContact O-CB 3.35Å; S1442-T1445 PolarHBondContact O-N 3.16Å
1443	F	66.3	Low	68.8	Low	110 Å²	110	58.2 Å²	58.2	48%	0.482	33%	0.33	S	S	.	.	H	α-helix	trans	-45.9	-30.4	164.9	179.8	-113.8	0	0	0	112.6	I1433 T1445 Y1446 I1447	I1433-F1443 HydrophobicContact CG2-CD2 4.33Å; I1433-F1443 HydrophobicContact CG2-CE2 4.4Å; F1443-T1445 VanDerWaalsContact C-N 3.31Å; F1443-T1445 PolarHBondContact O-N 3.1Å; F1443-Y1446 PolarHBondContact O-N 2.99Å; F1443-I1447 HydrophobicContact CD1-CD1 3.74Å; F1443-I1447 HydrophobicContact CD1-CG1 4.42Å; F1443-I1447 HydrophobicContact CE1-CD1 3.12Å; F1443-I1447 HydrophobicContact CE1-CG1 4.11Å; F1443-I1447 HydrophobicContact CE2-CD1 4.05Å; F1443-I1447 HydrophobicContact CE2-CG1 4.31Å; F1443-I1447 HydrophobicContact CG-CD1 4.43Å; F1443-I1447 HydrophobicContact CZ-CD1 3.32Å; F1443-I1447 HydrophobicContact CZ-CG1 4.06Å; F1443-I1447 PolarHBondContact O-N 2.8Å
1444	R	68.4	Low	69.4	Low	114 Å²	114	57.8 Å²	57.8	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-55.9	-38.4	171.9	176.3	167.7	-173.1	177.5	-0.1	113.6	Y787 S1442 S1448	Y787-R1444 HydrophobicContact CD1-CG 3.76Å; Y787-R1444 HydrophobicContact CE1-CB 3.93Å; Y787-R1444 HydrophobicContact CE1-CG 3.39Å; S1442-R1444 PolarHBondContact O-N 3.4Å; S1442-R1444 WeakPolarHBondContact OG-CB 3.17Å; S1442-R1444 PolarHBondContact OG-N 2.95Å; R1444-S1448 WeakPolarHBondContact O-CB 3.26Å; R1444-S1448 PolarHBondContact O-N 3.26Å
1445	T	67.7	Low	70.1	Confident	39 Å²	39	56.4 Å²	56.4	24%	0.239	32%	0.315	C	S	.	.	H	α-helix	trans	-71.9	-41.9	179.8	-52.2	0	0	0	0	110.9	I994 I1441 S1442 F1443 S1448	I994-T1445 HydrophobicContact CD1-CG2 4.3Å; I994-T1445 HydrophobicContact CG1-CG2 4.09Å; I994-T1445 HydrophobicContact CG2-CG2 3.83Å; I1441-T1445 HydrophobicContact CG2-CG2 4.36Å; I1441-T1445 WeakPolarHBondContact CG2-OG1 3.49Å; S1442-T1445 WeakPolarHBondContact O-CB 3.35Å; S1442-T1445 PolarHBondContact O-N 3.16Å; F1443-T1445 VanDerWaalsContact C-N 3.31Å; F1443-T1445 PolarHBondContact O-N 3.1Å; T1445-S1448 WeakPolarHBondContact O-CB 3.48Å; T1445-S1448 PolarHBondContact O-N 3.12Å; T1445-S1448 VanDerWaalsContact O-N 3.13Å; T1445-S1448 PolarHBondContact O-OG 3.3Å
1446	Y	68.5	Low	71.1	Confident	24 Å²	24	56.4 Å²	56.4	9%	0.094	32%	0.322	C	S	.	.	H	α-helix	trans	-61.5	-45.8	174.7	175.5	-92.2	0	0	0	111.6	E1429 Q1432 I1433 F1443 S1448 D1449 N1452	E1429-Y1446 PolarHBondContact OE2-OH 3.48Å; Q1432-Y1446 HydrophobicContact CB-CE2 4.44Å; I1433-Y1446 HydrophobicContact CD1-CE1 3.88Å; I1433-Y1446 HydrophobicContact CG1-CD1 4Å; I1433-Y1446 HydrophobicContact CG1-CE1 3.57Å; I1433-Y1446 HydrophobicContact CG1-CE2 4.16Å; I1433-Y1446 HydrophobicContact CG1-CG 4.46Å; F1443-Y1446 PolarHBondContact O-N 2.99Å; Y1446-S1448 PolarHBondContact O-N 3.35Å; Y1446-D1449 PolarHBondContact O-N 3.46Å; Y1446-N1452 HydrophobicContact CD1-CB 4.44Å; Y1446-N1452 WeakPolarHBondContact CD2-ND2 3.4Å; Y1446-N1452 HydrophobicContact CE1-CB 3.99Å; Y1446-N1452 HydrophobicContact CE2-CB 4.26Å; Y1446-N1452 WeakPolarHBondContact CE2-ND2 3.38Å; Y1446-N1452 PolarHBondContact O-ND2 3.03Å; Y1446-N1452 VanDerWaalsContact O-ND2 3.13Å
1447	I	74.1	Confident	72.3	Confident	65 Å²	65	57.6 Å²	57.6	33%	0.333	33%	0.333	S	S	.	.	H	α-helix	trans	-67.5	-22.8	175.5	-73	-172.2	0	0	0	112.3	F1443 D1449 K1453	F1443-I1447 HydrophobicContact CD1-CD1 3.74Å; F1443-I1447 HydrophobicContact CD1-CG1 4.42Å; F1443-I1447 HydrophobicContact CE1-CD1 3.12Å; F1443-I1447 HydrophobicContact CE1-CG1 4.11Å; F1443-I1447 HydrophobicContact CE2-CD1 4.05Å; F1443-I1447 HydrophobicContact CE2-CG1 4.31Å; F1443-I1447 HydrophobicContact CG-CD1 4.43Å; F1443-I1447 HydrophobicContact CZ-CD1 3.32Å; F1443-I1447 HydrophobicContact CZ-CG1 4.06Å; F1443-I1447 PolarHBondContact O-N 2.8Å; I1447-D1449 PolarHBondContact O-N 3.37Å; I1447-K1453 WeakPolarHBondContact O-CE 3.24Å; I1447-K1453 WeakPolarHBondContact O-CG 3.47Å
1448	S	74.2	Confident	73.5	Confident	49 Å²	49	53.9 Å²	53.9	34%	0.343	31%	0.31	S	S	.	.	H	α-helix	trans	-68.5	-20.9	-178.8	75	0	0	0	0	113.6	R1444 T1445 Y1446	R1444-S1448 WeakPolarHBondContact O-CB 3.26Å; R1444-S1448 PolarHBondContact O-N 3.26Å; T1445-S1448 WeakPolarHBondContact O-CB 3.48Å; T1445-S1448 PolarHBondContact O-N 3.12Å; T1445-S1448 VanDerWaalsContact O-N 3.13Å; T1445-S1448 PolarHBondContact O-OG 3.3Å; Y1446-S1448 PolarHBondContact O-N 3.35Å
1449	D	73.1	Confident	74.9	Confident	29 Å²	29	48.6 Å²	48.6	16%	0.155	28%	0.282	C	S	.	.	S	Bend	trans	-74.1	126.9	176.4	-173.6	14.9	0	0	0	111.5	T995 Y1446 I1447 W1451 N1452 K1453	T995-D1449 HydrophobicContact CG2-CB 4.41Å; T995-D1449 WeakPolarHBondContact CG2-OD2 3.4Å; Y1446-D1449 PolarHBondContact O-N 3.46Å; I1447-D1449 PolarHBondContact O-N 3.37Å; D1449-W1451 PolarHBondContact O-N 3.23Å; D1449-W1451 PolarHBondContact OD1-N 2.97Å; D1449-N1452 HydrophobicContact CB-CB 4.29Å; D1449-N1452 PolarHBondContact O-N 3.26Å; D1449-K1453 WeakPolarHBondContact O-CG 3.36Å; D1449-K1453 PolarHBondContact O-N 2.89Å
1450	G	78.3	Confident	76.7	Confident	49 Å²	49	49.5 Å²	49.5	51%	0.505	29%	0.292	S	S	.	.	H	α-helix	trans	-59.7	-32.6	-178.1	0	0	0	0	0	113.1	L1454	G1450-L1454 PolarHBondContact O-N 3.07Å
1451	W	83.2	Confident	78.7	Confident	61 Å²	61	48.7 Å²	48.7	23%	0.231	27%	0.272	C	S	.	.	H	α-helix	trans	-74.5	-40.9	179.7	-65.1	104.3	0	0	0	113.1	D1449 K1453 L1454 D1455 M1516 Y1517 L1529	D1449-W1451 PolarHBondContact O-N 3.23Å; D1449-W1451 PolarHBondContact OD1-N 2.97Å; W1451-K1453 VanDerWaalsContact C-N 3.28Å; W1451-K1453 PolarHBondContact O-N 2.93Å; W1451-L1454 HydrophobicContact CE3-CD2 4.19Å; W1451-L1454 HydrophobicContact CZ3-CD2 4.26Å; W1451-L1454 WeakPolarHBondContact O-CB 3.1Å; W1451-L1454 PolarHBondContact O-N 3.45Å; W1451-L1454 VanDerWaalsContact O-N 3.13Å; W1451-D1455 PolarHBondContact O-N 3.44Å; W1451-M1516 HydrophobicContact CH2-CB 3.98Å; W1451-Y1517 AromaticContact CD1-CD2 3.83Å; W1451-Y1517 AromaticContact CD2-CD2 3.9Å; W1451-Y1517 HydrophobicContact CD2-CD2 3.9Å; W1451-Y1517 HydrophobicContact CD2-CG 4.3Å; W1451-Y1517 AromaticContact CE2-CD2 3.72Å; W1451-Y1517 AromaticContact CG-CD2 3.97Å; W1451-Y1517 HydrophobicContact CG-CD2 3.97Å; W1451-Y1517 HydrophobicContact CG-CE2 4.49Å; W1451-Y1517 HydrophobicContact CZ2-CD2 4.31Å; W1451-Y1517 AromaticContact NE1-CD2 3.66Å; W1451-L1529 HydrophobicContact CZ2-CD2 4.09Å
1452	N	83.1	Confident	80.4	Confident	13 Å²	13	48 Å²	48	7%	0.07	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-33.3	177.2	-62.9	-21.7	0	0	0	111.2	Y1446 D1449 L1454 D1455 C1456	Y1446-N1452 HydrophobicContact CD1-CB 4.44Å; Y1446-N1452 WeakPolarHBondContact CD2-ND2 3.4Å; Y1446-N1452 HydrophobicContact CE1-CB 3.99Å; Y1446-N1452 HydrophobicContact CE2-CB 4.26Å; Y1446-N1452 WeakPolarHBondContact CE2-ND2 3.38Å; Y1446-N1452 PolarHBondContact O-ND2 3.03Å; Y1446-N1452 VanDerWaalsContact O-ND2 3.13Å; D1449-N1452 HydrophobicContact CB-CB 4.29Å; D1449-N1452 PolarHBondContact O-N 3.26Å; N1452-L1454 VanDerWaalsContact C-N 3.33Å; N1452-D1455 PolarHBondContact O-N 3.32Å; N1452-C1456 WeakPolarHBondContact O-CB 3.37Å; N1452-C1456 PolarHBondContact O-N 3.35Å; N1452-C1456 PolarHBondContact O-SG 3.35Å
1453	K	85.8	Confident	82	Confident	117 Å²	117	48 Å²	48	51%	0.509	26%	0.261	S	S	.	.	H	α-helix	trans	-60.1	-43.4	170.8	-68.2	-178.8	-174.8	-174.5	0	111.6	I1447 D1449 W1451 A1457	I1447-K1453 WeakPolarHBondContact O-CE 3.24Å; I1447-K1453 WeakPolarHBondContact O-CG 3.47Å; D1449-K1453 WeakPolarHBondContact O-CG 3.36Å; D1449-K1453 PolarHBondContact O-N 2.89Å; W1451-K1453 VanDerWaalsContact C-N 3.28Å; W1451-K1453 PolarHBondContact O-N 2.93Å; K1453-A1457 WeakPolarHBondContact O-CB 3.27Å; K1453-A1457 PolarHBondContact O-N 3.37Å
1454	L	87.7	Confident	83.3	Confident	36 Å²	36	46.8 Å²	46.8	19%	0.188	26%	0.259	C	S	.	.	H	α-helix	trans	-65.6	-42.9	178.7	-174.1	71.9	0	0	0	111.8	G1450 W1451 N1452 A1457 G1458 T1510 I1513 R1514	G1450-L1454 PolarHBondContact O-N 3.07Å; W1451-L1454 HydrophobicContact CE3-CD2 4.19Å; W1451-L1454 HydrophobicContact CZ3-CD2 4.26Å; W1451-L1454 WeakPolarHBondContact O-CB 3.1Å; W1451-L1454 PolarHBondContact O-N 3.45Å; W1451-L1454 VanDerWaalsContact O-N 3.13Å; N1452-L1454 VanDerWaalsContact C-N 3.33Å; L1454-A1457 PolarHBondContact O-N 2.94Å; L1454-G1458 PolarHBondContact O-N 2.93Å; L1454-T1510 HydrophobicContact CD1-CG2 4.34Å; L1454-I1513 HydrophobicContact CD1-CG2 4.48Å; L1454-I1513 HydrophobicContact CD2-CB 3.85Å; L1454-I1513 HydrophobicContact CD2-CG2 3.47Å; L1454-I1513 VanDerWaalsContact CD2-CG2 3.47Å; L1454-R1514 HydrophobicContact CD2-CB 4.33Å
1455	D	85.7	Confident	84.3	Confident	14 Å²	14	41.3 Å²	41.3	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-42.9	177.1	-71.8	-19	0	0	0	111.7	W1451 N1452 A1457 G1458 L1459 R1514	W1451-D1455 PolarHBondContact O-N 3.44Å; N1452-D1455 PolarHBondContact O-N 3.32Å; D1455-A1457 PolarHBondContact O-N 2.96Å; D1455-G1458 PolarHBondContact O-N 2.84Å; D1455-L1459 WeakPolarHBondContact O-CB 3.45Å; D1455-L1459 WeakPolarHBondContact O-CG 3.32Å; D1455-L1459 PolarHBondContact O-N 2.89Å; D1455-R1514 VanDerWaalsContact CG-NE 3.27Å; D1455-R1514 WeakPolarHBondContact OD1-CD 3.33Å; D1455-R1514 VanDerWaalsContact OD1-CG 3.23Å; D1455-R1514 WeakPolarHBondContact OD1-CG 3.4Å; D1455-R1514 IonicContact OD1-NE 3.21Å; D1455-R1514 PolarHBondContact OD1-NE 2.88Å; D1455-R1514 IonicContact OD2-CZ 3.84Å; D1455-R1514 IonicContact OD2-NE 3.17Å; D1455-R1514 PolarHBondContact OD2-NE 3.47Å; D1455-R1514 IonicContact OD2-NH2 3.48Å; D1455-R1514 PolarHBondContact OD2-NH2 3.01Å
1456	C	87	Confident	85.4	Confident	52 Å²	52	42.4 Å²	42.4	35%	0.351	24%	0.24	S	C	.	.	H	α-helix	trans	-62.4	-41.6	174.6	-69.4	0	0	0	0	111.8	N1452 A1460	N1452-C1456 WeakPolarHBondContact O-CB 3.37Å; N1452-C1456 PolarHBondContact O-N 3.35Å; N1452-C1456 PolarHBondContact O-SG 3.35Å; C1456-A1460 VanDerWaalsContact O-CB 3.25Å; C1456-A1460 WeakPolarHBondContact O-CB 3.2Å; C1456-A1460 PolarHBondContact O-N 3.49Å
1457	A	89.3	Confident	86.4	Confident	44 Å²	44	45.4 Å²	45.4	36%	0.364	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-43.8	175.9	0	0	0	0	0	111.3	K1453 L1454 D1455 A1460 L1461	K1453-A1457 WeakPolarHBondContact O-CB 3.27Å; K1453-A1457 PolarHBondContact O-N 3.37Å; L1454-A1457 PolarHBondContact O-N 2.94Å; D1455-A1457 PolarHBondContact O-N 2.96Å; A1457-A1460 PolarHBondContact O-N 3.46Å; A1457-L1461 WeakPolarHBondContact O-CB 3Å; A1457-L1461 VanDerWaalsContact O-CG 3.27Å; A1457-L1461 WeakPolarHBondContact O-CG 3.49Å; A1457-L1461 PolarHBondContact O-N 3.16Å
1458	G	90.9	Very high	87.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-42.2	177.7	0	0	0	0	0	113.8	L1454 D1455 Y1462 S1507 T1510	L1454-G1458 PolarHBondContact O-N 2.93Å; D1455-G1458 PolarHBondContact O-N 2.84Å; G1458-Y1462 WeakPolarHBondContact O-CB 3.5Å; G1458-Y1462 PolarHBondContact O-N 3.32Å; G1458-S1507 PolarHBondContact O-OG 3.5Å; G1458-T1510 WeakPolarHBondContact CA-OG1 3.21Å
1459	L	90.8	Very high	87.8	Confident	14 Å²	14	42 Å²	42	7%	0.073	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-42.5	174.8	-74.3	168.7	0	0	0	112.1	V1422 F1426 E1429 D1455 Y1462 I1463 F1511	V1422-L1459 HydrophobicContact CG1-CD2 3.97Å; F1426-L1459 HydrophobicContact CB-CD2 4.41Å; F1426-L1459 HydrophobicContact CD2-CD1 4.4Å; E1429-L1459 HydrophobicContact CB-CD1 4.27Å; E1429-L1459 HydrophobicContact CG-CD1 3.9Å; D1455-L1459 WeakPolarHBondContact O-CB 3.45Å; D1455-L1459 WeakPolarHBondContact O-CG 3.32Å; D1455-L1459 PolarHBondContact O-N 2.89Å; L1459-Y1462 PolarHBondContact O-N 3.23Å; L1459-I1463 VanDerWaalsContact O-CG1 3.29Å; L1459-I1463 WeakPolarHBondContact O-CG1 3.32Å; L1459-I1463 PolarHBondContact O-N 3.26Å; L1459-F1511 HydrophobicContact CD2-CZ 4.19Å; L1459-F1511 HydrophobicContact CG-CZ 4.42Å
1460	A	90.9	Very high	88.4	Confident	46 Å²	46	44.2 Å²	44.2	38%	0.38	25%	0.246	S	C	.	.	H	α-helix	trans	-62.3	-45.2	177.1	0	0	0	0	0	111.5	C1456 A1457 Y1462 I1463 I1464	C1456-A1460 VanDerWaalsContact O-CB 3.25Å; C1456-A1460 WeakPolarHBondContact O-CB 3.2Å; C1456-A1460 PolarHBondContact O-N 3.49Å; A1457-A1460 PolarHBondContact O-N 3.46Å; A1460-Y1462 VanDerWaalsContact C-N 3.32Å; A1460-Y1462 PolarHBondContact O-N 3.26Å; A1460-I1463 PolarHBondContact O-N 3.1Å; A1460-I1464 VanDerWaalsContact O-CG1 3.28Å; A1460-I1464 WeakPolarHBondContact O-CG1 3.33Å; A1460-I1464 PolarHBondContact O-N 3.47Å
1461	L	92.7	Very high	88.8	Confident	45 Å²	45	45.4 Å²	45.4	24%	0.236	24%	0.24	C	C	.	.	H	α-helix	trans	-63.9	-36.6	175.6	-71.8	170.5	0	0	0	112.4	A1457 G1465 I1506 T1510	A1457-L1461 WeakPolarHBondContact O-CB 3Å; A1457-L1461 VanDerWaalsContact O-CG 3.27Å; A1457-L1461 WeakPolarHBondContact O-CG 3.49Å; A1457-L1461 PolarHBondContact O-N 3.16Å; L1461-G1465 PolarHBondContact O-N 2.95Å; L1461-I1506 HydrophobicContact CD1-CB 4.27Å; L1461-I1506 HydrophobicContact CD1-CG2 3.58Å; L1461-T1510 HydrophobicContact CD1-CG2 4.28Å
1462	Y	92.8	Very high	88.6	Confident	15 Å²	15	42.6 Å²	42.6	6%	0.059	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-46	173.5	-172.7	-90	0	0	0	111.4	F1399 V1418 V1422 G1458 L1459 A1460 G1465 F1466 L1504 S1507	F1399-Y1462 HydrophobicContact CE1-CD2 4.2Å; F1399-Y1462 HydrophobicContact CE1-CE2 4.4Å; F1399-Y1462 HydrophobicContact CE2-CD2 4.48Å; F1399-Y1462 HydrophobicContact CE2-CE2 4.07Å; F1399-Y1462 AromaticContact CZ-CD2 3.79Å; F1399-Y1462 HydrophobicContact CZ-CD2 3.79Å; F1399-Y1462 AromaticContact CZ-CE2 3.83Å; F1399-Y1462 HydrophobicContact CZ-CE2 3.83Å; V1418-Y1462 HydrophobicContact CG1-CE2 4.5Å; V1422-Y1462 HydrophobicContact CB-CD1 4.2Å; V1422-Y1462 HydrophobicContact CB-CE1 3.81Å; V1422-Y1462 HydrophobicContact CG1-CD1 3.51Å; V1422-Y1462 HydrophobicContact CG1-CE1 3.63Å; V1422-Y1462 HydrophobicContact CG1-CG 3.98Å; V1422-Y1462 HydrophobicContact CG2-CD1 4.35Å; V1422-Y1462 HydrophobicContact CG2-CD2 4.14Å; V1422-Y1462 HydrophobicContact CG2-CE1 3.97Å; V1422-Y1462 HydrophobicContact CG2-CE2 3.77Å; V1422-Y1462 HydrophobicContact CG2-CG 4.41Å; G1458-Y1462 WeakPolarHBondContact O-CB 3.5Å; G1458-Y1462 PolarHBondContact O-N 3.32Å; L1459-Y1462 PolarHBondContact O-N 3.23Å; A1460-Y1462 VanDerWaalsContact C-N 3.32Å; A1460-Y1462 PolarHBondContact O-N 3.26Å; Y1462-G1465 PolarHBondContact O-N 3.25Å; Y1462-F1466 HydrophobicContact CD1-CB 4.38Å; Y1462-F1466 HydrophobicContact CE1-CB 4.24Å; Y1462-F1466 VanDerWaalsContact O-CB 3.23Å; Y1462-F1466 WeakPolarHBondContact O-CB 3.43Å; Y1462-F1466 PolarHBondContact O-N 3.46Å; Y1462-L1504 HydrophobicContact CD2-CD2 3.69Å; Y1462-L1504 HydrophobicContact CE2-CD2 3.86Å; Y1462-L1504 HydrophobicContact CG-CD2 4.31Å; Y1462-S1507 WeakPolarHBondContact CB-OG 3.24Å
1463	I	91.9	Very high	88.4	Confident	71 Å²	71	43.8 Å²	43.8	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-63.1	-43.5	179.3	-68.2	165.1	0	0	0	110.3	F1426 L1459 A1460 F1466 I1467	F1426-I1463 HydrophobicContact CE2-CD1 4.29Å; L1459-I1463 VanDerWaalsContact O-CG1 3.29Å; L1459-I1463 WeakPolarHBondContact O-CG1 3.32Å; L1459-I1463 PolarHBondContact O-N 3.26Å; A1460-I1463 PolarHBondContact O-N 3.1Å; I1463-F1466 PolarHBondContact O-N 3.34Å; I1463-I1467 HydrophobicContact CG2-CD1 3.68Å; I1463-I1467 HydrophobicContact CG2-CG1 4.27Å; I1463-I1467 WeakPolarHBondContact O-CB 3Å; I1463-I1467 VanDerWaalsContact O-CG1 3.24Å; I1463-I1467 WeakPolarHBondContact O-CG1 3.37Å; I1463-I1467 PolarHBondContact O-N 3.2Å
1464	I	92.6	Very high	88.1	Confident	85 Å²	85	44 Å²	44	44%	0.436	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-49.4	175	-67.5	164.3	0	0	0	110.1	A1460 F1466 I1467 L1468	A1460-I1464 VanDerWaalsContact O-CG1 3.28Å; A1460-I1464 WeakPolarHBondContact O-CG1 3.33Å; A1460-I1464 PolarHBondContact O-N 3.47Å; I1464-F1466 VanDerWaalsContact C-N 3.3Å; I1464-F1466 PolarHBondContact O-N 3.34Å; I1464-I1467 PolarHBondContact O-N 2.72Å; I1464-L1468 HydrophobicContact CG2-CD1 4.03Å; I1464-L1468 WeakPolarHBondContact O-CB 3.49Å; I1464-L1468 VanDerWaalsContact O-CG 3.28Å; I1464-L1468 WeakPolarHBondContact O-CG 2.79Å; I1464-L1468 PolarHBondContact O-N 2.92Å
1465	G	90.5	Very high	87.5	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-40.6	176.4	0	0	0	0	0	112.7	L1461 Y1462 R1469	L1461-G1465 PolarHBondContact O-N 2.95Å; Y1462-G1465 PolarHBondContact O-N 3.25Å; G1465-R1469 WeakPolarHBondContact O-CB 3.38Å; G1465-R1469 PolarHBondContact O-N 2.76Å
1466	F	89.9	Confident	86.7	Confident	62 Å²	62	49.1 Å²	49.1	27%	0.272	26%	0.259	S	S	.	.	H	α-helix	trans	-70.7	-38	178.3	-177.1	-102.5	0	0	0	112.7	I1419 Y1462 I1463 I1464 R1469 L1470	I1419-F1466 HydrophobicContact CD1-CD2 4.41Å; I1419-F1466 HydrophobicContact CD1-CE2 3.62Å; I1419-F1466 HydrophobicContact CD1-CZ 4.42Å; I1419-F1466 HydrophobicContact CG1-CD2 4.37Å; I1419-F1466 HydrophobicContact CG1-CE2 3.94Å; Y1462-F1466 HydrophobicContact CD1-CB 4.38Å; Y1462-F1466 HydrophobicContact CE1-CB 4.24Å; Y1462-F1466 VanDerWaalsContact O-CB 3.23Å; Y1462-F1466 WeakPolarHBondContact O-CB 3.43Å; Y1462-F1466 PolarHBondContact O-N 3.46Å; I1463-F1466 PolarHBondContact O-N 3.34Å; I1464-F1466 VanDerWaalsContact C-N 3.3Å; I1464-F1466 PolarHBondContact O-N 3.34Å; F1466-R1469 CarbonylContact O-C 3.58Å; F1466-R1469 WeakPolarHBondContact O-CB 3.5Å; F1466-R1469 PolarHBondContact O-N 2.97Å; F1466-L1470 VanDerWaalsContact O-CB 3.31Å; F1466-L1470 WeakPolarHBondContact O-CB 3.44Å; F1466-L1470 PolarHBondContact O-N 3.37Å
1467	I	90.9	Very high	85.6	Confident	86 Å²	86	49.2 Å²	49.2	44%	0.441	27%	0.268	S	S	.	.	H	α-helix	trans	-66.2	-46	174.2	-70.2	167.2	0	0	0	109.9	I1463 I1464 R1469 L1470 I1471	I1463-I1467 HydrophobicContact CG2-CD1 3.68Å; I1463-I1467 HydrophobicContact CG2-CG1 4.27Å; I1463-I1467 WeakPolarHBondContact O-CB 3Å; I1463-I1467 VanDerWaalsContact O-CG1 3.24Å; I1463-I1467 WeakPolarHBondContact O-CG1 3.37Å; I1463-I1467 PolarHBondContact O-N 3.2Å; I1464-I1467 PolarHBondContact O-N 2.72Å; I1467-R1469 VanDerWaalsContact C-N 3.27Å; I1467-R1469 PolarHBondContact O-N 3.43Å; I1467-L1470 PolarHBondContact O-N 2.92Å; I1467-L1470 VanDerWaalsContact O-N 3.15Å; I1467-I1471 HydrophobicContact CG2-CD1 3.94Å; I1467-I1471 HydrophobicContact CG2-CG1 4.45Å; I1467-I1471 VanDerWaalsContact O-CG1 3.29Å; I1467-I1471 WeakPolarHBondContact O-CG1 3.3Å; I1467-I1471 PolarHBondContact O-N 3.12Å
1468	L	89.6	Confident	84.2	Confident	42 Å²	42	55.4 Å²	55.4	22%	0.22	29%	0.29	C	S	.	.	H	α-helix	trans	-59.4	-41.8	174.6	-67.9	172.2	0	0	0	110.9	I1464 I1471 V1472 I1496 P1499	I1464-L1468 HydrophobicContact CG2-CD1 4.03Å; I1464-L1468 WeakPolarHBondContact O-CB 3.49Å; I1464-L1468 VanDerWaalsContact O-CG 3.28Å; I1464-L1468 WeakPolarHBondContact O-CG 2.79Å; I1464-L1468 PolarHBondContact O-N 2.92Å; L1468-I1471 PolarHBondContact O-N 3.35Å; L1468-V1472 WeakPolarHBondContact O-CG2 3.36Å; L1468-V1472 PolarHBondContact O-N 3.39Å; L1468-V1472 VanDerWaalsContact O-N 3.09Å; L1468-I1496 HydrophobicContact CB-CG2 4.46Å; L1468-I1496 HydrophobicContact CD2-CG2 4.17Å; L1468-P1499 HydrophobicContact CD1-CB 4.42Å
1469	R	87.3	Confident	82.7	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-41.1	174.1	-179.3	65.6	171.6	132.4	9.2	112.6	R1408 I1409 E1415 G1465 F1466 I1467 V1472 L1473	R1408-R1469 VanDerWaalsContact O-CZ 3.23Å; R1408-R1469 PolarHBondContact O-NH1 3.45Å; R1408-R1469 PolarHBondContact O-NH2 3.17Å; I1409-R1469 PolarHBondContact O-NH1 3.47Å; I1409-R1469 PolarHBondContact O-NH2 3.3Å; E1415-R1469 IonicContact OE1-CZ 3.75Å; E1415-R1469 IonicContact OE1-NE 2.84Å; E1415-R1469 PolarHBondContact OE1-NE 3.07Å; E1415-R1469 IonicContact OE1-NH2 3.38Å; E1415-R1469 PolarHBondContact OE1-NH2 3.29Å; E1415-R1469 IonicContact OE2-NH2 3.53Å; E1415-R1469 PolarHBondContact OE2-NH2 3.11Å; E1415-R1469 VanDerWaalsContact OE2-NH2 3.17Å; G1465-R1469 WeakPolarHBondContact O-CB 3.38Å; G1465-R1469 PolarHBondContact O-N 2.76Å; F1466-R1469 CarbonylContact O-C 3.58Å; F1466-R1469 WeakPolarHBondContact O-CB 3.5Å; F1466-R1469 PolarHBondContact O-N 2.97Å; I1467-R1469 VanDerWaalsContact C-N 3.27Å; I1467-R1469 PolarHBondContact O-N 3.43Å; R1469-V1472 PolarHBondContact O-N 3.15Å; R1469-L1473 PolarHBondContact O-N 2.86Å; R1469-L1473 VanDerWaalsContact O-N 3.07Å
1470	L	85.7	Confident	80.9	Confident	74 Å²	74	66 Å²	66	39%	0.387	34%	0.344	S	S	.	.	H	α-helix	trans	-68.3	-38.4	176.7	-174.7	67	0	0	0	111.5	F1466 I1467 V1472 L1473 L1474	F1466-L1470 VanDerWaalsContact O-CB 3.31Å; F1466-L1470 WeakPolarHBondContact O-CB 3.44Å; F1466-L1470 PolarHBondContact O-N 3.37Å; I1467-L1470 PolarHBondContact O-N 2.92Å; I1467-L1470 VanDerWaalsContact O-N 3.15Å; L1470-V1472 VanDerWaalsContact C-N 3.32Å; L1470-V1472 PolarHBondContact O-N 2.9Å; L1470-L1473 PolarHBondContact O-N 2.85Å; L1470-L1474 HydrophobicContact CG-CD1 4.18Å; L1470-L1474 HydrophobicContact CG-CG 4.43Å; L1470-L1474 WeakPolarHBondContact O-CB 3.24Å; L1470-L1474 WeakPolarHBondContact O-CG 3.42Å; L1470-L1474 PolarHBondContact O-N 3.25Å
1471	I	85.6	Confident	79	Confident	74 Å²	74	68.9 Å²	68.9	38%	0.379	35%	0.353	S	S	.	.	H	α-helix	trans	-60.3	-43.6	174.3	-70.3	164.7	0	0	0	110.1	I1467 L1468 L1474 R1475 I1496	I1467-I1471 HydrophobicContact CG2-CD1 3.94Å; I1467-I1471 HydrophobicContact CG2-CG1 4.45Å; I1467-I1471 VanDerWaalsContact O-CG1 3.29Å; I1467-I1471 WeakPolarHBondContact O-CG1 3.3Å; I1467-I1471 PolarHBondContact O-N 3.12Å; L1468-I1471 PolarHBondContact O-N 3.35Å; I1471-L1474 PolarHBondContact O-N 2.97Å; I1471-R1475 VanDerWaalsContact O-CB 3.24Å; I1471-R1475 WeakPolarHBondContact O-CB 3.45Å; I1471-R1475 PolarHBondContact O-N 2.86Å; I1471-I1496 HydrophobicContact CG2-CD1 4.24Å
1472	V	79.8	Confident	77.4	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.012	36%	0.358	C	S	.	.	H	α-helix	trans	-61.9	-44.8	175.3	176	0	0	0	0	111	L1468 R1469 L1470 L1474 R1475 L1476 I1496 L1497	L1468-V1472 WeakPolarHBondContact O-CG2 3.36Å; L1468-V1472 PolarHBondContact O-N 3.39Å; L1468-V1472 VanDerWaalsContact O-N 3.09Å; R1469-V1472 PolarHBondContact O-N 3.15Å; L1470-V1472 VanDerWaalsContact C-N 3.32Å; L1470-V1472 PolarHBondContact O-N 2.9Å; V1472-L1474 PolarHBondContact O-N 3.42Å; V1472-R1475 PolarHBondContact O-N 3.44Å; V1472-L1476 HydrophobicContact CG1-CD1 3.72Å; V1472-L1476 HydrophobicContact CG1-CG 4.23Å; V1472-L1476 WeakPolarHBondContact O-CB 3.39Å; V1472-L1476 VanDerWaalsContact O-CG 3.32Å; V1472-L1476 WeakPolarHBondContact O-CG 3.36Å; V1472-L1476 PolarHBondContact O-N 3.39Å; V1472-I1496 HydrophobicContact CG2-CB 3.91Å; V1472-I1496 HydrophobicContact CG2-CG2 3.73Å; V1472-L1497 HydrophobicContact CG1-CD1 4.25Å; V1472-L1497 HydrophobicContact CG2-CD1 4.43Å
1473	L	78.7	Confident	75.7	Confident	39 Å²	39	74.7 Å²	74.7	20%	0.204	38%	0.382	C	S	.	.	H	α-helix	trans	-61.9	-41.5	176.7	-79.4	161.7	0	0	0	113	I1409 I1411 R1469 L1470 G1477	I1409-L1473 VanDerWaalsContact O-CD2 3.24Å; I1409-L1473 WeakPolarHBondContact O-CD2 3.39Å; I1411-L1473 HydrophobicContact CD1-CD1 3.77Å; I1411-L1473 HydrophobicContact CG1-CD1 3.68Å; I1411-L1473 HydrophobicContact CG1-CD2 4.33Å; R1469-L1473 PolarHBondContact O-N 2.86Å; R1469-L1473 VanDerWaalsContact O-N 3.07Å; L1470-L1473 PolarHBondContact O-N 2.85Å; L1473-G1477 WeakPolarHBondContact O-CA 3.36Å; L1473-G1477 PolarHBondContact O-N 2.81Å
1474	L	79.3	Confident	74.2	Confident	121 Å²	121	77.9 Å²	77.9	63%	0.634	40%	0.398	S	S	*	.	H	α-helix	trans	-68.2	-38.9	176.7	-71.5	172.4	0	0	0	111.7	L1470 I1471 V1472	L1470-L1474 HydrophobicContact CG-CD1 4.18Å; L1470-L1474 HydrophobicContact CG-CG 4.43Å; L1470-L1474 WeakPolarHBondContact O-CB 3.24Å; L1470-L1474 WeakPolarHBondContact O-CG 3.42Å; L1470-L1474 PolarHBondContact O-N 3.25Å; I1471-L1474 PolarHBondContact O-N 2.97Å; V1472-L1474 PolarHBondContact O-N 3.42Å
1475	R	75.2	Confident	72.7	Confident	140 Å²	140	82.7 Å²	82.7	53%	0.528	42%	0.416	S	S	.	.	H	α-helix	trans	-67.5	-44.7	179.6	-166.5	-175	-137.1	-177	5.2	111.8	I1471 V1472 D1494	I1471-R1475 VanDerWaalsContact O-CB 3.24Å; I1471-R1475 WeakPolarHBondContact O-CB 3.45Å; I1471-R1475 PolarHBondContact O-N 2.86Å; V1472-R1475 PolarHBondContact O-N 3.44Å; R1475-D1494 IonicContact NH1-OD1 3.66Å
1476	L	69.8	Low	71.3	Confident	18 Å²	18	89.5 Å²	89.5	9%	0.094	44%	0.443	C	S	.	.	H	α-helix	trans	-80.8	-23.3	-179.3	-59.7	-176.6	0	0	0	112.1	I1409 V1472 Q1478 E1479 F1482 Y1490	I1409-L1476 HydrophobicContact CD1-CD1 4.26Å; I1409-L1476 HydrophobicContact CG2-CD1 3.88Å; V1472-L1476 HydrophobicContact CG1-CD1 3.72Å; V1472-L1476 HydrophobicContact CG1-CG 4.23Å; V1472-L1476 WeakPolarHBondContact O-CB 3.39Å; V1472-L1476 VanDerWaalsContact O-CG 3.32Å; V1472-L1476 WeakPolarHBondContact O-CG 3.36Å; V1472-L1476 PolarHBondContact O-N 3.39Å; L1476-Q1478 VanDerWaalsContact C-N 3.27Å; L1476-Q1478 PolarHBondContact O-N 3.17Å; L1476-E1479 PolarHBondContact O-N 3.34Å; L1476-F1482 HydrophobicContact CB-CE2 3.76Å; L1476-F1482 HydrophobicContact CB-CZ 3.86Å; L1476-F1482 HydrophobicContact CD1-CZ 3.9Å; L1476-F1482 HydrophobicContact CD2-CE2 4.46Å; L1476-F1482 HydrophobicContact CD2-CZ 4.03Å; L1476-F1482 HydrophobicContact CG-CE2 4.48Å; L1476-F1482 HydrophobicContact CG-CZ 4.12Å; L1476-Y1490 HydrophobicContact CD2-CD1 4.31Å; L1476-Y1490 HydrophobicContact CD2-CE1 4.31Å
1477	G	63.4	Low	70.1	Confident	53 Å²	53	88.2 Å²	88.2	55%	0.546	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-13.3	-179.8	0	0	0	0	0	116.3	L1473 E1479	L1473-G1477 WeakPolarHBondContact O-CA 3.36Å; L1473-G1477 PolarHBondContact O-N 2.81Å; G1477-E1479 VanDerWaalsContact C-N 3.32Å
1478	Q	60.7	Low	68.9	Low	174 Å²	174	94.3 Å²	94.3	81%	0.813	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-21.9	169.3	-90.1	-173.3	-65.2	0	0	112.7	L1476 N1480	L1476-Q1478 VanDerWaalsContact C-N 3.27Å; L1476-Q1478 PolarHBondContact O-N 3.17Å; Q1478-N1480 PolarHBondContact O-N 2.66Å
1479	E	59.7	Low	67.8	Low	84 Å²	84	99.5 Å²	99.5	39%	0.393	47%	0.473	S	S	.	.			trans	-91.1	100	-179.8	-76	-159.3	-172.9	0	0	110.4	L1476 G1477 N1481 F1482	L1476-E1479 PolarHBondContact O-N 3.34Å; G1477-E1479 VanDerWaalsContact C-N 3.32Å; E1479-N1481 HydrophobicContact CB-CB 4.05Å; E1479-N1481 WeakPolarHBondContact CB-ND2 3.41Å; E1479-N1481 VanDerWaalsContact CD-ND2 3.3Å; E1479-N1481 WeakPolarHBondContact CG-ND2 3.47Å; E1479-N1481 PolarHBondContact O-N 3.39Å; E1479-N1481 PolarHBondContact OE2-ND2 3.24Å; E1479-F1482 HydrophobicContact CB-CD2 4.44Å; E1479-F1482 HydrophobicContact CB-CE2 4.22Å
1480	N	51.7	Low	66.8	Low	153 Å²	153	102.8 Å²	102.8	82%	0.818	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	43.9	175.4	-75.8	-113.8	0	0	0	110.4	Q1478	Q1478-N1480 PolarHBondContact O-N 2.66Å
1481	N	52	Low	65.9	Low	106 Å²	106	101.7 Å²	101.7	57%	0.567	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	-13.6	-159.3	-59.1	-9.5	0	0	0	113.1	E1479 N1483	E1479-N1481 HydrophobicContact CB-CB 4.05Å; E1479-N1481 WeakPolarHBondContact CB-ND2 3.41Å; E1479-N1481 VanDerWaalsContact CD-ND2 3.3Å; E1479-N1481 WeakPolarHBondContact CG-ND2 3.47Å; E1479-N1481 PolarHBondContact O-N 3.39Å; E1479-N1481 PolarHBondContact OE2-ND2 3.24Å; N1481-N1483 PolarHBondContact O-N 2.63Å
1482	F	57.7	Low	65.1	Low	79 Å²	79	103.3 Å²	103.3	35%	0.346	49%	0.493	S	S	.	.			trans	-67.8	97.7	-148	-103.3	-87	0	0	0	114.2	I1409 L1476 E1479 Y1490	I1409-F1482 HydrophobicContact CD1-CE1 3.87Å; L1476-F1482 HydrophobicContact CB-CE2 3.76Å; L1476-F1482 HydrophobicContact CB-CZ 3.86Å; L1476-F1482 HydrophobicContact CD1-CZ 3.9Å; L1476-F1482 HydrophobicContact CD2-CE2 4.46Å; L1476-F1482 HydrophobicContact CD2-CZ 4.03Å; L1476-F1482 HydrophobicContact CG-CE2 4.48Å; L1476-F1482 HydrophobicContact CG-CZ 4.12Å; E1479-F1482 HydrophobicContact CB-CD2 4.44Å; E1479-F1482 HydrophobicContact CB-CE2 4.22Å; F1482-Y1490 AromaticContact CE1-CD2 3.98Å; F1482-Y1490 HydrophobicContact CE1-CD2 3.98Å; F1482-Y1490 HydrophobicContact CE1-CE2 4.38Å; F1482-Y1490 HydrophobicContact CZ-CD2 4.22Å; F1482-Y1490 HydrophobicContact CZ-CE2 4.34Å
1483	N	57	Low	64.5	Low	103 Å²	103	106.3 Å²	106.3	55%	0.551	51%	0.511	S	S	*	.			trans	-79.7	128.4	172	-132.6	-36.1	0	0	0	109.2	N1481 K1485 Y1486	N1481-N1483 PolarHBondContact O-N 2.63Å; N1483-K1485 PolarHBondContact O-N 2.65Å; N1483-Y1486 HydrophobicContact CB-CD2 3.61Å; N1483-Y1486 HydrophobicContact CB-CE2 4.07Å; N1483-Y1486 PolarHBondContact O-N 2.94Å
1484	I	61	Low	64.2	Low	139 Å²	139	105 Å²	105	71%	0.713	50%	0.504	S	S	*	.	H	α-helix	trans	-51.7	-27.5	-177.6	-64.6	167.6	0	0	0	112.7	E1487	I1484-E1487 WeakPolarHBondContact O-CB 3.24Å; I1484-E1487 PolarHBondContact O-N 3.43Å
1485	K	61.2	Low	64.2	Low	185 Å²	185	103.9 Å²	103.9	80%	0.804	50%	0.504	S	S	*	.	H	α-helix	trans	-72.9	-28.6	179.6	-149.1	176.6	-175.3	-176.8	0	113.6	N1483	N1483-K1485 PolarHBondContact O-N 2.65Å
1486	Y	62.1	Low	64.6	Low	144 Å²	144	99.1 Å²	99.1	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-84.4	-15.3	176.6	-64.3	-69.1	0	0	0	112.4	N1483 R1488 Y1489 Y1490	N1483-Y1486 HydrophobicContact CB-CD2 3.61Å; N1483-Y1486 HydrophobicContact CB-CE2 4.07Å; N1483-Y1486 PolarHBondContact O-N 2.94Å; Y1486-R1488 VanDerWaalsContact C-N 3.34Å; Y1486-R1488 PolarHBondContact O-N 3Å; Y1486-Y1489 WeakPolarHBondContact O-CB 3.43Å; Y1486-Y1489 PolarHBondContact O-N 3.43Å; Y1486-Y1489 VanDerWaalsContact O-N 3.09Å; Y1486-Y1490 VanDerWaalsContact O-CD2 3.31Å; Y1486-Y1490 WeakPolarHBondContact O-CD2 3.5Å; Y1486-Y1490 PolarHBondContact O-N 3.29Å
1487	E	64	Low	65.2	Low	35 Å²	35	98.7 Å²	98.7	16%	0.164	49%	0.487	C	S	.	.	H	α-helix	trans	-57.9	-44	178	-162.9	178.8	178.1	0	0	111.9	I1409 I1484 Y1489 I1491	I1409-E1487 HydrophobicContact CB-CG 4.19Å; I1409-E1487 HydrophobicContact CD1-CB 4.33Å; I1409-E1487 HydrophobicContact CD1-CG 3.57Å; I1409-E1487 HydrophobicContact CG1-CG 3.66Å; I1409-E1487 PolarHBondContact N-OE1 2.94Å; I1484-E1487 WeakPolarHBondContact O-CB 3.24Å; I1484-E1487 PolarHBondContact O-N 3.43Å; E1487-Y1489 VanDerWaalsContact C-N 3.3Å; E1487-Y1489 PolarHBondContact O-N 3.37Å; E1487-I1491 HydrophobicContact CG-CD1 4.13Å; E1487-I1491 WeakPolarHBondContact O-CD1 3.48Å; E1487-I1491 WeakPolarHBondContact O-CG1 3.29Å; E1487-I1491 PolarHBondContact O-N 3.09Å; E1487-I1491 VanDerWaalsContact O-N 3.07Å
1488	R	65.7	Low	66.1	Low	213 Å²	213	100 Å²	100	80%	0.804	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-31.5	176.6	-72.7	-173.1	-171.2	179.6	2	113.6	Y1486 V1492	Y1486-R1488 VanDerWaalsContact C-N 3.34Å; Y1486-R1488 PolarHBondContact O-N 3Å; R1488-V1492 WeakPolarHBondContact O-CG2 3.09Å
1489	Y	67.1	Low	67.3	Low	152 Å²	152	94 Å²	94	60%	0.596	46%	0.457	S	S	*	.	H	α-helix	trans	-71.2	-52.8	178.6	-177	-99.2	0	0	0	109.6	Y1486 E1487 I1491 V1492 T1493	Y1486-Y1489 WeakPolarHBondContact O-CB 3.43Å; Y1486-Y1489 PolarHBondContact O-N 3.43Å; Y1486-Y1489 VanDerWaalsContact O-N 3.09Å; E1487-Y1489 VanDerWaalsContact C-N 3.3Å; E1487-Y1489 PolarHBondContact O-N 3.37Å; Y1489-I1491 PolarHBondContact O-N 3.07Å; Y1489-V1492 PolarHBondContact O-N 3.31Å; Y1489-T1493 WeakPolarHBondContact CD1-OG1 3.26Å; Y1489-T1493 HydrophobicContact CD2-CG2 4.34Å; Y1489-T1493 HydrophobicContact CE1-CG2 4.07Å; Y1489-T1493 WeakPolarHBondContact CE1-OG1 3.35Å; Y1489-T1493 HydrophobicContact CE2-CG2 3.85Å; Y1489-T1493 PolarHBondContact O-N 3.48Å; Y1489-T1493 PolarHBondContact O-OG1 3.46Å
1490	Y	66.2	Low	68.7	Low	70 Å²	70	90 Å²	90	28%	0.275	44%	0.438	S	S	.	.	H	α-helix	trans	-59.1	-31.8	178.3	-82	-72.5	0	0	0	113.6	L1476 F1482 Y1486 V1492 D1494	L1476-Y1490 HydrophobicContact CD2-CD1 4.31Å; L1476-Y1490 HydrophobicContact CD2-CE1 4.31Å; F1482-Y1490 AromaticContact CE1-CD2 3.98Å; F1482-Y1490 HydrophobicContact CE1-CD2 3.98Å; F1482-Y1490 HydrophobicContact CE1-CE2 4.38Å; F1482-Y1490 HydrophobicContact CZ-CD2 4.22Å; F1482-Y1490 HydrophobicContact CZ-CE2 4.34Å; Y1486-Y1490 VanDerWaalsContact O-CD2 3.31Å; Y1486-Y1490 WeakPolarHBondContact O-CD2 3.5Å; Y1486-Y1490 PolarHBondContact O-N 3.29Å; Y1490-V1492 PolarHBondContact O-N 3.08Å; Y1490-D1494 WeakPolarHBondContact O-CB 3.26Å; Y1490-D1494 PolarHBondContact O-N 3.03Å
1491	I	66.7	Low	70.5	Confident	51 Å²	51	88.5 Å²	88.5	26%	0.262	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-27.1	175.3	-70.9	165	0	0	0	112.8	I1409 E1487 Y1489 L1497	I1409-I1491 HydrophobicContact CD1-CG1 4.29Å; I1409-I1491 HydrophobicContact CG1-CD1 4.25Å; I1409-I1491 HydrophobicContact CG1-CG1 3.93Å; E1487-I1491 HydrophobicContact CG-CD1 4.13Å; E1487-I1491 WeakPolarHBondContact O-CD1 3.48Å; E1487-I1491 WeakPolarHBondContact O-CG1 3.29Å; E1487-I1491 PolarHBondContact O-N 3.09Å; E1487-I1491 VanDerWaalsContact O-N 3.07Å; Y1489-I1491 PolarHBondContact O-N 3.07Å; I1491-L1497 HydrophobicContact CB-CD2 4.1Å; I1491-L1497 HydrophobicContact CG1-CD2 4.06Å; I1491-L1497 HydrophobicContact CG2-CD2 4.13Å
1492	V	68.4	Low	72.3	Confident	108 Å²	108	88.3 Å²	88.3	66%	0.655	42%	0.419	S	S	*	.	H	α-helix	trans	-101.6	-24.9	-176	178.6	0	0	0	0	112.5	R1488 Y1489 Y1490	R1488-V1492 WeakPolarHBondContact O-CG2 3.09Å; Y1489-V1492 PolarHBondContact O-N 3.31Å; Y1490-V1492 PolarHBondContact O-N 3.08Å
1493	T	67.3	Low	73.9	Confident	65 Å²	65	85.7 Å²	85.7	40%	0.399	41%	0.41	S	S	.	.	H	α-helix	trans	-106.1	-13.4	-173.9	44.2	0	0	0	0	115.4	Y1489 P1495	Y1489-T1493 WeakPolarHBondContact CD1-OG1 3.26Å; Y1489-T1493 HydrophobicContact CD2-CG2 4.34Å; Y1489-T1493 HydrophobicContact CE1-CG2 4.07Å; Y1489-T1493 WeakPolarHBondContact CE1-OG1 3.35Å; Y1489-T1493 HydrophobicContact CE2-CG2 3.85Å; Y1489-T1493 PolarHBondContact O-N 3.48Å; Y1489-T1493 PolarHBondContact O-OG1 3.46Å; T1493-P1495 VanDerWaalsContact O-CD 3.23Å; T1493-P1495 WeakPolarHBondContact O-CD 3.36Å
1494	D	71.7	Confident	75.6	Confident	11 Å²	11	81.2 Å²	81.2	6%	0.059	39%	0.387	C	S	.	.			trans	-75.7	114.6	-178.6	-166.5	-17.8	0	0	0	110.9	R1475 Y1490 I1496 L1497	R1475-D1494 IonicContact NH1-OD1 3.66Å; Y1490-D1494 WeakPolarHBondContact O-CB 3.26Å; Y1490-D1494 PolarHBondContact O-N 3.03Å; D1494-I1496 PolarHBondContact O-N 3.41Å; D1494-I1496 PolarHBondContact OD1-N 2.97Å; D1494-I1496 VanDerWaalsContact OD1-N 3.15Å; D1494-L1497 HydrophobicContact CB-CB 4.09Å; D1494-L1497 PolarHBondContact O-N 2.95Å; D1494-L1497 VanDerWaalsContact O-N 3.07Å
1495	P	80.3	Confident	77.1	Confident	99 Å²	99	77 Å²	77	64%	0.643	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-12.6	-177.9	26.5	-36.8	0	0	0	113.9	T1493 P1499	T1493-P1495 VanDerWaalsContact O-CD 3.23Å; T1493-P1495 WeakPolarHBondContact O-CD 3.36Å; P1495-P1499 WeakPolarHBondContact O-CD 3.23Å; P1495-P1499 VanDerWaalsContact O-CG 3.26Å; P1495-P1499 WeakPolarHBondContact O-CG 3.2Å
1496	I	82.7	Confident	78.6	Confident	39 Å²	39	72 Å²	72	20%	0.2	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-24	179.2	-53.3	179.1	0	0	0	111.8	L1468 I1471 V1472 D1494 P1499 S1500	L1468-I1496 HydrophobicContact CB-CG2 4.46Å; L1468-I1496 HydrophobicContact CD2-CG2 4.17Å; I1471-I1496 HydrophobicContact CG2-CD1 4.24Å; V1472-I1496 HydrophobicContact CG2-CB 3.91Å; V1472-I1496 HydrophobicContact CG2-CG2 3.73Å; D1494-I1496 PolarHBondContact O-N 3.41Å; D1494-I1496 PolarHBondContact OD1-N 2.97Å; D1494-I1496 VanDerWaalsContact OD1-N 3.15Å; I1496-P1499 WeakPolarHBondContact O-CD 3.37Å; I1496-P1499 VanDerWaalsContact O-CG 3.3Å; I1496-P1499 WeakPolarHBondContact O-CG 3.43Å; I1496-S1500 PolarHBondContact O-N 3.44Å
1497	L	81.9	Confident	80.1	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-75.3	-41.3	-177.1	-169.1	72.1	0	0	0	112	F1407 V1472 I1491 D1494 S1500 R1501	F1407-L1497 HydrophobicContact CE1-CD1 3.91Å; F1407-L1497 HydrophobicContact CE1-CG 4.39Å; F1407-L1497 HydrophobicContact CZ-CD1 4.4Å; V1472-L1497 HydrophobicContact CG1-CD1 4.25Å; V1472-L1497 HydrophobicContact CG2-CD1 4.43Å; I1491-L1497 HydrophobicContact CB-CD2 4.1Å; I1491-L1497 HydrophobicContact CG1-CD2 4.06Å; I1491-L1497 HydrophobicContact CG2-CD2 4.13Å; D1494-L1497 HydrophobicContact CB-CB 4.09Å; D1494-L1497 PolarHBondContact O-N 2.95Å; D1494-L1497 VanDerWaalsContact O-N 3.07Å; L1497-S1500 WeakPolarHBondContact O-CB 3.32Å; L1497-S1500 PolarHBondContact O-N 3.44Å; L1497-S1500 VanDerWaalsContact O-N 3.16Å; L1497-S1500 PolarHBondContact O-OG 3.03Å; L1497-R1501 PolarHBondContact O-N 3.24Å
1498	D	82.3	Confident	81.5	Confident	80 Å²	80	64.4 Å²	64.4	43%	0.428	32%	0.324	S	S	.	.	H	α-helix	trans	-55.6	-51.9	175.3	-73.4	-24.3	0	0	0	113	S1500 R1501 I1502	D1498-S1500 VanDerWaalsContact C-N 3.3Å; D1498-S1500 PolarHBondContact O-N 3.24Å; D1498-R1501 PolarHBondContact O-N 3.34Å; D1498-I1502 VanDerWaalsContact O-CG1 3.3Å; D1498-I1502 WeakPolarHBondContact O-CG1 3.45Å; D1498-I1502 PolarHBondContact O-N 3.32Å
1499	P	87.8	Confident	82.8	Confident	48 Å²	48	60.4 Å²	60.4	31%	0.312	31%	0.312	S	S	.	.	H	α-helix	trans	-64.5	-34.1	176.1	22.8	-31.4	0	0	0	112.1	L1468 P1495 I1496 R1501 I1502 C1503	L1468-P1499 HydrophobicContact CD1-CB 4.42Å; P1495-P1499 WeakPolarHBondContact O-CD 3.23Å; P1495-P1499 VanDerWaalsContact O-CG 3.26Å; P1495-P1499 WeakPolarHBondContact O-CG 3.2Å; I1496-P1499 WeakPolarHBondContact O-CD 3.37Å; I1496-P1499 VanDerWaalsContact O-CG 3.3Å; I1496-P1499 WeakPolarHBondContact O-CG 3.43Å; P1499-R1501 VanDerWaalsContact C-N 3.33Å; P1499-R1501 PolarHBondContact O-N 2.77Å; P1499-I1502 PolarHBondContact O-N 3.21Å; P1499-C1503 WeakPolarHBondContact O-CB 3.31Å; P1499-C1503 PolarHBondContact O-N 3.36Å; P1499-C1503 PolarHBondContact O-SG 3.12Å
1500	S	88.2	Confident	83.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-42.5	175.5	82.6	0	0	0	0	112.1	I1496 L1497 D1498 L1504	I1496-S1500 PolarHBondContact O-N 3.44Å; L1497-S1500 WeakPolarHBondContact O-CB 3.32Å; L1497-S1500 PolarHBondContact O-N 3.44Å; L1497-S1500 VanDerWaalsContact O-N 3.16Å; L1497-S1500 PolarHBondContact O-OG 3.03Å; D1498-S1500 VanDerWaalsContact C-N 3.3Å; D1498-S1500 PolarHBondContact O-N 3.24Å; S1500-L1504 WeakPolarHBondContact O-CG 3.29Å; S1500-L1504 PolarHBondContact O-N 3.41Å
1501	R	88.8	Confident	85.1	Confident	122 Å²	122	50.8 Å²	50.8	46%	0.46	28%	0.276	S	S	.	.	H	α-helix	trans	-69.7	-40.8	179	-171.7	-179.2	-177.8	-167	1	111.4	F1407 L1497 D1498 P1499 L1504 A1505	F1407-R1501 HydrophobicContact CE1-CB 4.43Å; L1497-R1501 PolarHBondContact O-N 3.24Å; D1498-R1501 PolarHBondContact O-N 3.34Å; P1499-R1501 VanDerWaalsContact C-N 3.33Å; P1499-R1501 PolarHBondContact O-N 2.77Å; R1501-L1504 PolarHBondContact O-N 3.47Å; R1501-A1505 WeakPolarHBondContact O-CB 3.37Å; R1501-A1505 PolarHBondContact O-N 3.11Å
1502	I	90.4	Very high	86.3	Confident	102 Å²	102	53.2 Å²	53.2	52%	0.523	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-46.9	175.7	-66.8	165.5	0	0	0	110.2	D1498 P1499 L1504 A1505 I1506	D1498-I1502 VanDerWaalsContact O-CG1 3.3Å; D1498-I1502 WeakPolarHBondContact O-CG1 3.45Å; D1498-I1502 PolarHBondContact O-N 3.32Å; P1499-I1502 PolarHBondContact O-N 3.21Å; I1502-L1504 PolarHBondContact O-N 3.27Å; I1502-A1505 PolarHBondContact O-N 3.49Å; I1502-I1506 HydrophobicContact CG2-CD1 3.84Å; I1502-I1506 HydrophobicContact CG2-CG1 4.39Å; I1502-I1506 WeakPolarHBondContact O-CG1 3.27Å; I1502-I1506 PolarHBondContact O-N 3.47Å
1503	C	92	Very high	87.4	Confident	24 Å²	24	50.9 Å²	50.9	16%	0.162	27%	0.266	C	S	.	.	H	α-helix	trans	-59.4	-44.3	176.9	-71.9	0	0	0	0	112.2	P1499 I1506 S1507	P1499-C1503 WeakPolarHBondContact O-CB 3.31Å; P1499-C1503 PolarHBondContact O-N 3.36Å; P1499-C1503 PolarHBondContact O-SG 3.12Å; C1503-I1506 PolarHBondContact O-N 2.92Å; C1503-S1507 WeakPolarHBondContact O-CB 3.05Å; C1503-S1507 PolarHBondContact O-N 2.95Å
1504	L	91.6	Very high	88.4	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.052	25%	0.253	C	S	.	.	H	α-helix	trans	-66.7	-34.8	176	-68.3	173	0	0	0	112.5	F1399 L1403 F1407 Y1462 S1500 R1501 I1502 S1507 L1508	F1399-L1504 HydrophobicContact CZ-CB 4.38Å; F1399-L1504 HydrophobicContact CZ-CD2 4.34Å; L1403-L1504 HydrophobicContact CD1-CB 4.28Å; L1403-L1504 HydrophobicContact CD2-CB 3.77Å; L1403-L1504 HydrophobicContact CD2-CD1 4.23Å; F1407-L1504 HydrophobicContact CE2-CD1 3.78Å; F1407-L1504 HydrophobicContact CZ-CD1 4.17Å; Y1462-L1504 HydrophobicContact CD2-CD2 3.69Å; Y1462-L1504 HydrophobicContact CE2-CD2 3.86Å; Y1462-L1504 HydrophobicContact CG-CD2 4.31Å; S1500-L1504 WeakPolarHBondContact O-CG 3.29Å; S1500-L1504 PolarHBondContact O-N 3.41Å; R1501-L1504 PolarHBondContact O-N 3.47Å; I1502-L1504 PolarHBondContact O-N 3.27Å; L1504-S1507 WeakPolarHBondContact O-CB 3.5Å; L1504-S1507 PolarHBondContact O-N 3.21Å; L1504-L1508 PolarHBondContact O-N 2.93Å
1505	A	92.9	Very high	89.1	Confident	49 Å²	49	50.7 Å²	50.7	41%	0.405	26%	0.26	S	S	.	.	H	α-helix	trans	-68.5	-42.2	176.2	0	0	0	0	0	112.4	R1501 I1502 S1507 L1508 F1509	R1501-A1505 WeakPolarHBondContact O-CB 3.37Å; R1501-A1505 PolarHBondContact O-N 3.11Å; I1502-A1505 PolarHBondContact O-N 3.49Å; A1505-S1507 VanDerWaalsContact C-N 3.32Å; A1505-L1508 PolarHBondContact O-N 2.81Å; A1505-F1509 PolarHBondContact O-N 2.73Å
1506	I	92.7	Very high	89.4	Confident	80 Å²	80	49.9 Å²	49.9	41%	0.41	25%	0.249	S	C	.	.	H	α-helix	trans	-66.5	-38.7	174	-59.1	169.2	0	0	0	109.7	L1461 I1502 C1503 L1508 F1509 T1510	L1461-I1506 HydrophobicContact CD1-CB 4.27Å; L1461-I1506 HydrophobicContact CD1-CG2 3.58Å; I1502-I1506 HydrophobicContact CG2-CD1 3.84Å; I1502-I1506 HydrophobicContact CG2-CG1 4.39Å; I1502-I1506 WeakPolarHBondContact O-CG1 3.27Å; I1502-I1506 PolarHBondContact O-N 3.47Å; C1503-I1506 PolarHBondContact O-N 2.92Å; I1506-L1508 PolarHBondContact O-N 3.18Å; I1506-F1509 WeakPolarHBondContact O-CB 3.5Å; I1506-F1509 PolarHBondContact O-N 3.04Å; I1506-T1510 WeakPolarHBondContact O-CG2 3.33Å; I1506-T1510 PolarHBondContact O-N 3.03Å
1507	S	93.3	Very high	89.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.7	-47.5	172	178.8	0	0	0	0	111.6	G1458 Y1462 C1503 L1504 A1505 F1509 T1510 F1511	G1458-S1507 PolarHBondContact O-OG 3.5Å; Y1462-S1507 WeakPolarHBondContact CB-OG 3.24Å; C1503-S1507 WeakPolarHBondContact O-CB 3.05Å; C1503-S1507 PolarHBondContact O-N 2.95Å; L1504-S1507 WeakPolarHBondContact O-CB 3.5Å; L1504-S1507 PolarHBondContact O-N 3.21Å; A1505-S1507 VanDerWaalsContact C-N 3.32Å; S1507-F1509 VanDerWaalsContact C-N 3.3Å; S1507-F1509 PolarHBondContact O-N 3.46Å; S1507-T1510 PolarHBondContact O-N 3.09Å; S1507-T1510 PolarHBondContact O-OG1 2.68Å; S1507-F1511 WeakPolarHBondContact O-CD2 3.24Å; S1507-F1511 PolarHBondContact O-N 3.02Å; S1507-F1511 VanDerWaalsContact O-N 3.13Å; S1507-F1511 WeakPolarHBondContact OG-CE2 3.49Å
1508	L	93.1	Very high	89.6	Confident	21 Å²	21	51.1 Å²	51.1	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-57.7	-41.9	174.6	177.6	62.7	0	0	0	112.1	L1396 F1399 L1403 L1504 A1505 I1506 T1510 F1511 Y1512	L1396-L1508 HydrophobicContact CD2-CD1 4.2Å; F1399-L1508 HydrophobicContact CB-CD1 4.14Å; F1399-L1508 HydrophobicContact CD1-CB 4.06Å; F1399-L1508 HydrophobicContact CD1-CD1 3.53Å; F1399-L1508 HydrophobicContact CD1-CG 4.34Å; F1399-L1508 HydrophobicContact CE1-CB 3.78Å; F1399-L1508 HydrophobicContact CE1-CD1 4.16Å; F1399-L1508 HydrophobicContact CG-CD1 3.99Å; F1399-L1508 HydrophobicContact CZ-CB 4.28Å; L1403-L1508 HydrophobicContact CD1-CB 4.04Å; L1403-L1508 HydrophobicContact CD1-CD2 3.89Å; L1504-L1508 PolarHBondContact O-N 2.93Å; A1505-L1508 PolarHBondContact O-N 2.81Å; I1506-L1508 PolarHBondContact O-N 3.18Å; L1508-T1510 PolarHBondContact O-N 3.42Å; L1508-F1511 PolarHBondContact O-N 2.93Å; L1508-Y1512 HydrophobicContact CD1-CD2 3.93Å; L1508-Y1512 HydrophobicContact CD1-CE2 3.74Å; L1508-Y1512 HydrophobicContact CD2-CE2 4.31Å; L1508-Y1512 HydrophobicContact CG-CD2 3.95Å; L1508-Y1512 HydrophobicContact CG-CE2 3.92Å; L1508-Y1512 WeakPolarHBondContact O-CD2 3.45Å; L1508-Y1512 PolarHBondContact O-N 3.03Å
1509	F	92.8	Very high	89.8	Confident	128 Å²	128	52.4 Å²	52.4	56%	0.561	26%	0.255	S	S	*	.	H	α-helix	trans	-60.5	-43.8	176.6	176.2	-105.9	0	0	0	112.7	A1505 I1506 S1507 F1511 Y1512 I1513	A1505-F1509 PolarHBondContact O-N 2.73Å; I1506-F1509 WeakPolarHBondContact O-CB 3.5Å; I1506-F1509 PolarHBondContact O-N 3.04Å; S1507-F1509 VanDerWaalsContact C-N 3.3Å; S1507-F1509 PolarHBondContact O-N 3.46Å; F1509-F1511 VanDerWaalsContact C-N 3.33Å; F1509-F1511 PolarHBondContact O-N 2.74Å; F1509-Y1512 WeakPolarHBondContact O-CB 3.28Å; F1509-Y1512 PolarHBondContact O-N 3.44Å; F1509-Y1512 VanDerWaalsContact O-N 3.08Å; F1509-I1513 HydrophobicContact CD1-CD1 4.07Å; F1509-I1513 HydrophobicContact CE1-CD1 3.41Å; F1509-I1513 VanDerWaalsContact CE1-CD1 3.41Å; F1509-I1513 HydrophobicContact CE1-CG1 4.22Å; F1509-I1513 HydrophobicContact CE2-CD1 4.41Å; F1509-I1513 HydrophobicContact CE2-CG1 4.46Å; F1509-I1513 HydrophobicContact CZ-CD1 3.62Å; F1509-I1513 HydrophobicContact CZ-CG1 4.12Å; F1509-I1513 PolarHBondContact O-N 3.33Å
1510	T	91.1	Very high	89.5	Confident	13 Å²	13	50.9 Å²	50.9	8%	0.08	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-38.7	176.3	60	0	0	0	0	112.4	L1454 G1458 L1461 I1506 S1507 L1508 Y1512 I1513 R1514	L1454-T1510 HydrophobicContact CD1-CG2 4.34Å; G1458-T1510 WeakPolarHBondContact CA-OG1 3.21Å; L1461-T1510 HydrophobicContact CD1-CG2 4.28Å; I1506-T1510 WeakPolarHBondContact O-CG2 3.33Å; I1506-T1510 PolarHBondContact O-N 3.03Å; S1507-T1510 PolarHBondContact O-N 3.09Å; S1507-T1510 PolarHBondContact O-OG1 2.68Å; L1508-T1510 PolarHBondContact O-N 3.42Å; T1510-Y1512 VanDerWaalsContact C-N 3.32Å; T1510-Y1512 PolarHBondContact O-N 2.94Å; T1510-I1513 PolarHBondContact O-N 3.43Å; T1510-R1514 PolarHBondContact O-N 3.08Å
1511	F	91.1	Very high	89.1	Confident	7 Å²	7	52.4 Å²	52.4	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-67.2	-30.4	173	-69	-57.5	0	0	0	112.5	Y1392 F1395 L1396 F1399 L1459 S1507 L1508 F1509 R1514	Y1392-F1511 PolarHBondContact OH-O 2.79Å; F1395-F1511 HydrophobicContact CE1-CB 4.41Å; F1395-F1511 HydrophobicContact CE1-CD1 4.43Å; F1395-F1511 HydrophobicContact CE1-CD2 4.17Å; F1395-F1511 HydrophobicContact CE1-CG 4.11Å; F1395-F1511 HydrophobicContact CZ-CD2 4.25Å; F1395-F1511 HydrophobicContact CZ-CE2 4.28Å; L1396-F1511 HydrophobicContact CD2-CB 3.75Å; F1399-F1511 HydrophobicContact CD1-CD2 4.42Å; F1399-F1511 HydrophobicContact CE1-CD2 4.12Å; F1399-F1511 HydrophobicContact CE1-CE2 4.36Å; L1459-F1511 HydrophobicContact CD2-CZ 4.19Å; L1459-F1511 HydrophobicContact CG-CZ 4.42Å; S1507-F1511 WeakPolarHBondContact O-CD2 3.24Å; S1507-F1511 PolarHBondContact O-N 3.02Å; S1507-F1511 VanDerWaalsContact O-N 3.13Å; S1507-F1511 WeakPolarHBondContact OG-CE2 3.49Å; L1508-F1511 PolarHBondContact O-N 2.93Å; F1509-F1511 VanDerWaalsContact C-N 3.33Å; F1509-F1511 PolarHBondContact O-N 2.74Å; F1511-R1514 WeakPolarHBondContact O-CB 3.44Å; F1511-R1514 PolarHBondContact O-N 3.43Å
1512	Y	92.3	Very high	88.9	Confident	103 Å²	103	51.3 Å²	51.3	40%	0.404	25%	0.253	S	S	.	.	H	α-helix	trans	-67.5	-43.4	171.3	-94.4	-75	0	0	0	112.9	L1396 S1400 L1508 F1509 T1510 R1514 L1515	L1396-Y1512 HydrophobicContact CD1-CD1 4.17Å; L1396-Y1512 HydrophobicContact CD1-CE1 4.18Å; L1396-Y1512 HydrophobicContact CD2-CD2 4.38Å; S1400-Y1512 PolarHBondContact OG-OH 3.12Å; L1508-Y1512 HydrophobicContact CD1-CD2 3.93Å; L1508-Y1512 HydrophobicContact CD1-CE2 3.74Å; L1508-Y1512 HydrophobicContact CD2-CE2 4.31Å; L1508-Y1512 HydrophobicContact CG-CD2 3.95Å; L1508-Y1512 HydrophobicContact CG-CE2 3.92Å; L1508-Y1512 WeakPolarHBondContact O-CD2 3.45Å; L1508-Y1512 PolarHBondContact O-N 3.03Å; F1509-Y1512 WeakPolarHBondContact O-CB 3.28Å; F1509-Y1512 PolarHBondContact O-N 3.44Å; F1509-Y1512 VanDerWaalsContact O-N 3.08Å; T1510-Y1512 VanDerWaalsContact C-N 3.32Å; T1510-Y1512 PolarHBondContact O-N 2.94Å; Y1512-R1514 PolarHBondContact O-N 3.13Å; Y1512-L1515 WeakPolarHBondContact O-CB 3.43Å; Y1512-L1515 PolarHBondContact O-N 2.99Å
1513	I	90.6	Very high	88.6	Confident	59 Å²	59	51.6 Å²	51.6	30%	0.303	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-38.5	176.2	-66.4	176.2	0	0	0	110.4	L1454 F1509 T1510 L1515 M1516	L1454-I1513 HydrophobicContact CD1-CG2 4.48Å; L1454-I1513 HydrophobicContact CD2-CB 3.85Å; L1454-I1513 HydrophobicContact CD2-CG2 3.47Å; L1454-I1513 VanDerWaalsContact CD2-CG2 3.47Å; F1509-I1513 HydrophobicContact CD1-CD1 4.07Å; F1509-I1513 HydrophobicContact CE1-CD1 3.41Å; F1509-I1513 VanDerWaalsContact CE1-CD1 3.41Å; F1509-I1513 HydrophobicContact CE1-CG1 4.22Å; F1509-I1513 HydrophobicContact CE2-CD1 4.41Å; F1509-I1513 HydrophobicContact CE2-CG1 4.46Å; F1509-I1513 HydrophobicContact CZ-CD1 3.62Å; F1509-I1513 HydrophobicContact CZ-CG1 4.12Å; F1509-I1513 PolarHBondContact O-N 3.33Å; T1510-I1513 PolarHBondContact O-N 3.43Å; I1513-L1515 PolarHBondContact O-N 3.02Å; I1513-L1515 VanDerWaalsContact O-N 3.11Å; I1513-M1516 WeakPolarHBondContact O-CB 3.12Å; I1513-M1516 PolarHBondContact O-N 2.76Å
1514	R	88.2	Confident	88.2	Confident	34 Å²	34	52.9 Å²	52.9	13%	0.128	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-25.4	177.3	-178.8	57.2	160.2	149	-10.1	113.4	Y1392 L1454 D1455 T1510 F1511 Y1512 M1516 Y1517	Y1392-R1514 WeakPolarHBondContact OH-CB 3.22Å; Y1392-R1514 WeakPolarHBondContact OH-CG 3.37Å; L1454-R1514 HydrophobicContact CD2-CB 4.33Å; D1455-R1514 VanDerWaalsContact CG-NE 3.27Å; D1455-R1514 WeakPolarHBondContact OD1-CD 3.33Å; D1455-R1514 VanDerWaalsContact OD1-CG 3.23Å; D1455-R1514 WeakPolarHBondContact OD1-CG 3.4Å; D1455-R1514 IonicContact OD1-NE 3.21Å; D1455-R1514 PolarHBondContact OD1-NE 2.88Å; D1455-R1514 IonicContact OD2-CZ 3.84Å; D1455-R1514 IonicContact OD2-NE 3.17Å; D1455-R1514 PolarHBondContact OD2-NE 3.47Å; D1455-R1514 IonicContact OD2-NH2 3.48Å; D1455-R1514 PolarHBondContact OD2-NH2 3.01Å; T1510-R1514 PolarHBondContact O-N 3.08Å; F1511-R1514 WeakPolarHBondContact O-CB 3.44Å; F1511-R1514 PolarHBondContact O-N 3.43Å; Y1512-R1514 PolarHBondContact O-N 3.13Å; R1514-M1516 PolarHBondContact O-N 3.36Å; R1514-Y1517 WeakPolarHBondContact O-CB 3.02Å; R1514-Y1517 PolarHBondContact O-N 3.17Å
1515	L	87.6	Confident	87.9	Confident	38 Å²	38	56.2 Å²	56.2	20%	0.199	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-58.2	-32.5	174.9	-170.2	67.4	0	0	0	112.5	Y1392 I1393 L1396 Y1512 I1513 Y1517 T1518	Y1392-L1515 HydrophobicContact CD1-CD1 4.08Å; Y1392-L1515 HydrophobicContact CE1-CD1 4.36Å; I1393-L1515 HydrophobicContact CG1-CD1 4.25Å; L1396-L1515 HydrophobicContact CD1-CD1 4.45Å; L1396-L1515 HydrophobicContact CD1-CD2 4.49Å; Y1512-L1515 WeakPolarHBondContact O-CB 3.43Å; Y1512-L1515 PolarHBondContact O-N 2.99Å; I1513-L1515 PolarHBondContact O-N 3.02Å; I1513-L1515 VanDerWaalsContact O-N 3.11Å; L1515-Y1517 PolarHBondContact O-N 3.25Å; L1515-T1518 VanDerWaalsContact O-CB 3.25Å; L1515-T1518 WeakPolarHBondContact O-CB 3.36Å; L1515-T1518 PolarHBondContact O-N 3.02Å; L1515-T1518 PolarHBondContact O-OG1 3.32Å
1516	M	87	Confident	87.3	Confident	82 Å²	82	53.9 Å²	53.9	40%	0.404	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-58	-31.3	179.3	-68.8	-174.9	78.5	0	0	113	W1451 I1513 R1514 T1518 F1519 L1529	W1451-M1516 HydrophobicContact CH2-CB 3.98Å; I1513-M1516 WeakPolarHBondContact O-CB 3.12Å; I1513-M1516 PolarHBondContact O-N 2.76Å; R1514-M1516 PolarHBondContact O-N 3.36Å; M1516-T1518 PolarHBondContact O-N 3.08Å; M1516-F1519 WeakPolarHBondContact O-CB 3.34Å; M1516-F1519 PolarHBondContact O-N 3.46Å; M1516-L1529 HydrophobicContact CB-CD1 4.33Å; M1516-L1529 HydrophobicContact CE-CD1 3.57Å
1517	Y	85	Confident	86.8	Confident	46 Å²	46	50.7 Å²	50.7	18%	0.18	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-60.9	-31.1	176.5	-179	-104.5	0	0	0	112.3	W1451 R1514 L1515 F1519 S1520	W1451-Y1517 AromaticContact CD1-CD2 3.83Å; W1451-Y1517 AromaticContact CD2-CD2 3.9Å; W1451-Y1517 HydrophobicContact CD2-CD2 3.9Å; W1451-Y1517 HydrophobicContact CD2-CG 4.3Å; W1451-Y1517 AromaticContact CE2-CD2 3.72Å; W1451-Y1517 AromaticContact CG-CD2 3.97Å; W1451-Y1517 HydrophobicContact CG-CD2 3.97Å; W1451-Y1517 HydrophobicContact CG-CE2 4.49Å; W1451-Y1517 HydrophobicContact CZ2-CD2 4.31Å; W1451-Y1517 AromaticContact NE1-CD2 3.66Å; R1514-Y1517 WeakPolarHBondContact O-CB 3.02Å; R1514-Y1517 PolarHBondContact O-N 3.17Å; L1515-Y1517 PolarHBondContact O-N 3.25Å; Y1517-F1519 PolarHBondContact O-N 3.27Å; Y1517-S1520 VanDerWaalsContact O-CB 3.27Å; Y1517-S1520 WeakPolarHBondContact O-CB 3.48Å; Y1517-S1520 PolarHBondContact O-N 3.29Å; Y1517-S1520 VanDerWaalsContact O-N 3.12Å; Y1517-S1520 PolarHBondContact O-OG 3.34Å
1518	T	83.5	Confident	86.4	Confident	27 Å²	27	56 Å²	56	17%	0.166	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-64.1	-28.2	176.9	-48.8	0	0	0	0	111.9	F1385 T1389 L1515 M1516 S1520	F1385-T1518 HydrophobicContact CE2-CG2 3.94Å; F1385-T1518 HydrophobicContact CZ-CG2 3.71Å; T1389-T1518 HydrophobicContact CG2-CG2 3.81Å; L1515-T1518 VanDerWaalsContact O-CB 3.25Å; L1515-T1518 WeakPolarHBondContact O-CB 3.36Å; L1515-T1518 PolarHBondContact O-N 3.02Å; L1515-T1518 PolarHBondContact O-OG1 3.32Å; M1516-T1518 PolarHBondContact O-N 3.08Å; T1518-S1520 VanDerWaalsContact C-N 3.28Å; T1518-S1520 PolarHBondContact O-N 2.77Å
1519	F	84.8	Confident	86	Confident	107 Å²	107	56.8 Å²	56.8	47%	0.469	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-77.6	-10.5	177.8	-58.2	-43.6	0	0	0	113.6	M1516 Y1517 F1521 H1522 L1525	M1516-F1519 WeakPolarHBondContact O-CB 3.34Å; M1516-F1519 PolarHBondContact O-N 3.46Å; Y1517-F1519 PolarHBondContact O-N 3.27Å; F1519-F1521 PolarHBondContact O-N 3.23Å; F1519-H1522 WeakPolarHBondContact O-CB 3.35Å; F1519-H1522 PolarHBondContact O-N 3.23Å; F1519-H1522 VanDerWaalsContact O-N 3.12Å; F1519-L1525 HydrophobicContact CB-CB 4.47Å; F1519-L1525 HydrophobicContact CB-CD1 4.31Å
1520	S	82	Confident	85.4	Confident	16 Å²	16	52.4 Å²	52.4	11%	0.112	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-61.6	-26.7	179.3	66.1	0	0	0	0	113.8	Y1517 T1518 H1522 G1526	Y1517-S1520 VanDerWaalsContact O-CB 3.27Å; Y1517-S1520 WeakPolarHBondContact O-CB 3.48Å; Y1517-S1520 PolarHBondContact O-N 3.29Å; Y1517-S1520 VanDerWaalsContact O-N 3.12Å; Y1517-S1520 PolarHBondContact O-OG 3.34Å; T1518-S1520 VanDerWaalsContact C-N 3.28Å; T1518-S1520 PolarHBondContact O-N 2.77Å; S1520-H1522 VanDerWaalsContact C-N 3.32Å; S1520-H1522 PolarHBondContact O-N 2.92Å; S1520-G1526 WeakPolarHBondContact O-CA 3.21Å
1521	F	80.5	Confident	85.1	Confident	33 Å²	33	52.4 Å²	52.4	15%	0.145	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-77.3	-15.8	178.8	-152.4	-119.5	0	0	0	113.6	W1283 F1519 W1667 R1671 M1674 I1675	W1283-F1521 HydrophobicContact CD2-CE1 4.23Å; W1283-F1521 HydrophobicContact CD2-CZ 4.05Å; W1283-F1521 AromaticContact CE2-CE1 3.61Å; W1283-F1521 AromaticContact CE2-CZ 3.91Å; W1283-F1521 HydrophobicContact CE3-CZ 4.22Å; W1283-F1521 AromaticContact CH2-CE1 3.96Å; W1283-F1521 HydrophobicContact CH2-CE1 3.96Å; W1283-F1521 HydrophobicContact CH2-CZ 4.08Å; W1283-F1521 HydrophobicContact CZ2-CD1 4.17Å; W1283-F1521 AromaticContact CZ2-CE1 3.47Å; W1283-F1521 HydrophobicContact CZ2-CE1 3.47Å; W1283-F1521 VanDerWaalsContact CZ2-CE1 3.47Å; W1283-F1521 AromaticContact CZ2-CZ 3.94Å; W1283-F1521 HydrophobicContact CZ2-CZ 3.94Å; W1283-F1521 HydrophobicContact CZ3-CZ 4.22Å; W1283-F1521 AromaticContact NE1-CE1 3.96Å; F1519-F1521 PolarHBondContact O-N 3.23Å; F1521-W1667 PolarHBondContact O-NE1 3Å; F1521-R1671 HydrophobicContact CD2-CG 4.5Å; F1521-R1671 HydrophobicContact CE2-CB 4.37Å; F1521-R1671 HydrophobicContact CE2-CG 3.67Å; F1521-R1671 HydrophobicContact CZ-CG 4.02Å; F1521-M1674 HydrophobicContact CB-CE 3.82Å; F1521-M1674 HydrophobicContact CB-SD 3.75Å; F1521-M1674 HydrophobicContact CD1-CE 3.89Å; F1521-M1674 HydrophobicContact CD2-CB 3.89Å; F1521-M1674 HydrophobicContact CD2-CE 3.33Å; F1521-M1674 HydrophobicContact CD2-CG 4.41Å; F1521-M1674 HydrophobicContact CD2-SD 3.74Å; F1521-M1674 HydrophobicContact CE1-CE 4.25Å; F1521-M1674 HydrophobicContact CE2-CB 4.14Å; F1521-M1674 HydrophobicContact CE2-CE 3.73Å; F1521-M1674 HydrophobicContact CG-CE 3.41Å; F1521-M1674 VanDerWaalsContact CG-CE 3.41Å; F1521-M1674 HydrophobicContact CG-SD 3.92Å; F1521-M1674 HydrophobicContact CZ-CE 4.16Å; F1521-I1675 HydrophobicContact CE2-CD1 4.46Å; F1521-I1675 HydrophobicContact CE2-CG1 3.94Å; F1521-I1675 HydrophobicContact CZ-CD1 4.25Å; F1521-I1675 HydrophobicContact CZ-CG1 3.88Å
1522	H	84.6	Confident	84.9	Confident	99 Å²	99	56.5 Å²	56.5	46%	0.458	28%	0.278	S	S	.	.	S	Bend	trans	-75.2	128.9	178.7	-175.5	-84.8	0	0	0	110.6	F1519 S1520 A1524 L1525 G1526	F1519-H1522 WeakPolarHBondContact O-CB 3.35Å; F1519-H1522 PolarHBondContact O-N 3.23Å; F1519-H1522 VanDerWaalsContact O-N 3.12Å; S1520-H1522 VanDerWaalsContact C-N 3.32Å; S1520-H1522 PolarHBondContact O-N 2.92Å; H1522-A1524 VanDerWaalsContact C-N 3.26Å; H1522-A1524 PolarHBondContact ND1-N 3.5Å; H1522-A1524 PolarHBondContact O-N 3.36Å; H1522-A1524 VanDerWaalsContact O-N 3.13Å; H1522-L1525 HydrophobicContact CB-CB 4.1Å; H1522-L1525 HydrophobicContact CB-CD1 4.31Å; H1522-L1525 HydrophobicContact CB-CG 4.44Å; H1522-L1525 PolarHBondContact ND1-N 3.04Å; H1522-L1525 PolarHBondContact O-N 3.22Å; H1522-L1525 VanDerWaalsContact O-N 3.08Å; H1522-G1526 PolarHBondContact O-N 3.46Å
1523	I	83.1	Confident	84.4	Confident	108 Å²	108	53.2 Å²	53.2	55%	0.554	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-39.3	-173.2	-164.6	164	0	0	0	114.1	P1527 W1667	I1523-P1527 VanDerWaalsContact O-CD 3.29Å; I1523-P1527 WeakPolarHBondContact O-CD 3.34Å; I1523-W1667 VanDerWaalsContact CA-CE2 3.47Å; I1523-W1667 HydrophobicContact CB-CD2 4.27Å; I1523-W1667 HydrophobicContact CB-CH2 4.15Å; I1523-W1667 HydrophobicContact CB-CZ2 3.76Å; I1523-W1667 HydrophobicContact CD1-CE3 4.07Å; I1523-W1667 HydrophobicContact CD1-CH2 3.88Å; I1523-W1667 HydrophobicContact CD1-CZ2 4.36Å; I1523-W1667 HydrophobicContact CD1-CZ3 3.73Å; I1523-W1667 HydrophobicContact CG1-CD2 3.83Å; I1523-W1667 HydrophobicContact CG1-CE3 3.85Å; I1523-W1667 HydrophobicContact CG1-CG 4.47Å; I1523-W1667 HydrophobicContact CG1-CH2 4Å; I1523-W1667 HydrophobicContact CG1-CZ2 4Å; I1523-W1667 HydrophobicContact CG1-CZ3 3.95Å
1524	A	84	Confident	84.2	Confident	50 Å²	50	51.7 Å²	51.7	41%	0.413	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-20.7	-179.6	0	0	0	0	0	114.7	H1522 K1528	H1522-A1524 VanDerWaalsContact C-N 3.26Å; H1522-A1524 PolarHBondContact ND1-N 3.5Å; H1522-A1524 PolarHBondContact O-N 3.36Å; H1522-A1524 VanDerWaalsContact O-N 3.13Å; A1524-K1528 VanDerWaalsContact O-CD 3.3Å; A1524-K1528 WeakPolarHBondContact O-CD 3.37Å; A1524-K1528 VanDerWaalsContact O-CG 3.29Å; A1524-K1528 WeakPolarHBondContact O-CG 3.48Å
1525	L	85.3	Confident	84.2	Confident	81 Å²	81	51.3 Å²	51.3	42%	0.424	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-26.9	-176.3	-65.1	170.9	0	0	0	112	F1519 H1522 K1528 L1529	F1519-L1525 HydrophobicContact CB-CB 4.47Å; F1519-L1525 HydrophobicContact CB-CD1 4.31Å; H1522-L1525 HydrophobicContact CB-CB 4.1Å; H1522-L1525 HydrophobicContact CB-CD1 4.31Å; H1522-L1525 HydrophobicContact CB-CG 4.44Å; H1522-L1525 PolarHBondContact ND1-N 3.04Å; H1522-L1525 PolarHBondContact O-N 3.22Å; H1522-L1525 VanDerWaalsContact O-N 3.08Å; L1525-K1528 PolarHBondContact O-N 3.46Å; L1525-L1529 PolarHBondContact O-N 3.02Å
1526	G	81.4	Confident	84.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.3	-58.7	178	0	0	0	0	0	113	S1520 H1522 K1528 L1529 I1530	S1520-G1526 WeakPolarHBondContact O-CA 3.21Å; H1522-G1526 PolarHBondContact O-N 3.46Å; G1526-K1528 VanDerWaalsContact C-N 3.26Å; G1526-K1528 PolarHBondContact O-N 2.93Å; G1526-L1529 WeakPolarHBondContact O-CB 3.49Å; G1526-L1529 PolarHBondContact O-N 3.19Å; G1526-L1529 VanDerWaalsContact O-N 3.09Å; G1526-I1530 PolarHBondContact O-N 2.88Å
1527	P	81.4	Confident	84.1	Confident	12 Å²	12	52 Å²	52	8%	0.078	28%	0.278	C	S	.	.	H	α-helix	trans	-58.3	-37.5	176.3	-27.3	36.8	0	0	0	113.2	I1523 L1529 I1530 M1531 W1667	I1523-P1527 VanDerWaalsContact O-CD 3.29Å; I1523-P1527 WeakPolarHBondContact O-CD 3.34Å; P1527-L1529 VanDerWaalsContact C-N 3.33Å; P1527-L1529 PolarHBondContact O-N 3.39Å; P1527-I1530 PolarHBondContact O-N 3.13Å; P1527-M1531 WeakPolarHBondContact O-CB 3.04Å; P1527-M1531 PolarHBondContact O-N 2.76Å; P1527-W1667 HydrophobicContact CG-CB 3.91Å
1528	K	85.3	Confident	84.3	Confident	112 Å²	112	50.3 Å²	50.3	49%	0.487	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-36.7	176.5	-66.9	-175.1	-177.6	-166.6	0	112.3	A1524 L1525 G1526 M1531 I1532	A1524-K1528 VanDerWaalsContact O-CD 3.3Å; A1524-K1528 WeakPolarHBondContact O-CD 3.37Å; A1524-K1528 VanDerWaalsContact O-CG 3.29Å; A1524-K1528 WeakPolarHBondContact O-CG 3.48Å; L1525-K1528 PolarHBondContact O-N 3.46Å; G1526-K1528 VanDerWaalsContact C-N 3.26Å; G1526-K1528 PolarHBondContact O-N 2.93Å; K1528-M1531 PolarHBondContact O-N 3.29Å; K1528-I1532 VanDerWaalsContact O-CG1 3.26Å; K1528-I1532 WeakPolarHBondContact O-CG1 3.45Å; K1528-I1532 PolarHBondContact O-N 3.12Å
1529	L	84.8	Confident	84.7	Confident	37 Å²	37	49.2 Å²	49.2	19%	0.194	27%	0.265	C	S	.	.	H	α-helix	trans	-65.5	-40.9	175.1	-170.1	73.1	0	0	0	111.7	W1451 M1516 L1525 G1526 P1527 G1533	W1451-L1529 HydrophobicContact CZ2-CD2 4.09Å; M1516-L1529 HydrophobicContact CB-CD1 4.33Å; M1516-L1529 HydrophobicContact CE-CD1 3.57Å; L1525-L1529 PolarHBondContact O-N 3.02Å; G1526-L1529 WeakPolarHBondContact O-CB 3.49Å; G1526-L1529 PolarHBondContact O-N 3.19Å; G1526-L1529 VanDerWaalsContact O-N 3.09Å; P1527-L1529 VanDerWaalsContact C-N 3.33Å; P1527-L1529 PolarHBondContact O-N 3.39Å; L1529-G1533 PolarHBondContact O-N 3.29Å
1530	I	80.5	Confident	85	Confident	36 Å²	36	46.3 Å²	46.3	19%	0.185	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-44.6	173.5	-53.8	171.3	0	0	0	110	G1526 P1527 G1533 K1534 Q1670	G1526-I1530 PolarHBondContact O-N 2.88Å; P1527-I1530 PolarHBondContact O-N 3.13Å; I1530-G1533 CarbonylContact O-C 3.3Å; I1530-G1533 WeakPolarHBondContact O-CA 3.44Å; I1530-G1533 PolarHBondContact O-N 2.67Å; I1530-G1533 VanDerWaalsContact O-N 3.16Å; I1530-K1534 HydrophobicContact CG2-CD 4.06Å; I1530-K1534 HydrophobicContact CG2-CG 4.11Å; I1530-K1534 WeakPolarHBondContact O-CB 3.42Å; I1530-K1534 WeakPolarHBondContact O-CG 3.26Å; I1530-K1534 PolarHBondContact O-N 3.01Å; I1530-Q1670 HydrophobicContact CD1-CG 4.37Å
1531	M	83.4	Confident	85.4	Confident	14 Å²	14	50 Å²	50	7%	0.069	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-47.1	-179.6	-179.2	-171.8	-80.3	0	0	111.6	P1527 K1528 G1533 K1534 M1535 Y1656 I1659 E1660	P1527-M1531 WeakPolarHBondContact O-CB 3.04Å; P1527-M1531 PolarHBondContact O-N 2.76Å; K1528-M1531 PolarHBondContact O-N 3.29Å; M1531-G1533 VanDerWaalsContact C-N 3.32Å; M1531-G1533 PolarHBondContact O-N 3.34Å; M1531-K1534 PolarHBondContact O-N 3.12Å; M1531-M1535 HydrophobicContact CG-CE 3.33Å; M1531-M1535 HydrophobicContact CG-CG 4.43Å; M1531-M1535 HydrophobicContact CG-SD 3.79Å; M1531-M1535 WeakPolarHBondContact O-CB 3.14Å; M1531-M1535 VanDerWaalsContact O-CG 3.23Å; M1531-M1535 WeakPolarHBondContact O-CG 3.28Å; M1531-M1535 PolarHBondContact O-N 3.22Å; M1531-M1535 HydrophobicContact SD-CE 3.73Å; M1531-Y1656 HydrophobicContact CE-CD2 3.47Å; M1531-Y1656 VanDerWaalsContact CE-CD2 3.47Å; M1531-Y1656 HydrophobicContact CE-CE2 3.68Å; M1531-Y1656 HydrophobicContact CE-CG 3.97Å; M1531-Y1656 WeakPolarHBondContact CE-O 3.27Å; M1531-Y1656 HydrophobicContact SD-CD2 3.14Å; M1531-Y1656 WeakPolarHBondContact SD-CD2 2.99Å; M1531-Y1656 HydrophobicContact SD-CE2 3.53Å; M1531-Y1656 VanDerWaalsContact SD-CE2 3.53Å; M1531-Y1656 HydrophobicContact SD-CG 4.05Å; M1531-I1659 HydrophobicContact CB-CD1 4.25Å; M1531-I1659 HydrophobicContact CB-CG2 4.36Å; M1531-I1659 HydrophobicContact CE-CB 4.21Å; M1531-I1659 HydrophobicContact CE-CG2 4.31Å; M1531-I1659 HydrophobicContact CG-CD1 4.23Å; M1531-E1660 HydrophobicContact CE-CB 4.38Å
1532	I	87	Confident	85.8	Confident	92 Å²	92	51.2 Å²	51.2	47%	0.472	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-45.4	172.4	-68.3	163.8	0	0	0	110.2	K1528 K1534 M1535 V1536	K1528-I1532 VanDerWaalsContact O-CG1 3.26Å; K1528-I1532 WeakPolarHBondContact O-CG1 3.45Å; K1528-I1532 PolarHBondContact O-N 3.12Å; I1532-K1534 PolarHBondContact O-N 2.97Å; I1532-M1535 PolarHBondContact O-N 3.1Å; I1532-V1536 HydrophobicContact CG2-CG2 4.26Å; I1532-V1536 WeakPolarHBondContact O-CB 3.24Å; I1532-V1536 WeakPolarHBondContact O-CG2 3.47Å; I1532-V1536 PolarHBondContact O-N 3.45Å
1533	G	83.5	Confident	86	Confident	35 Å²	35	46.8 Å²	46.8	36%	0.361	26%	0.262	S	S	.	.	H	α-helix	trans	-58.3	-47.1	176.9	0	0	0	0	0	112.6	L1529 I1530 M1531 T1537	L1529-G1533 PolarHBondContact O-N 3.29Å; I1530-G1533 CarbonylContact O-C 3.3Å; I1530-G1533 WeakPolarHBondContact O-CA 3.44Å; I1530-G1533 PolarHBondContact O-N 2.67Å; I1530-G1533 VanDerWaalsContact O-N 3.16Å; M1531-G1533 VanDerWaalsContact C-N 3.32Å; M1531-G1533 PolarHBondContact O-N 3.34Å; G1533-T1537 WeakPolarHBondContact O-CG2 3.5Å; G1533-T1537 PolarHBondContact O-N 3.29Å; G1533-T1537 PolarHBondContact O-OG1 3.48Å; G1533-T1537 VanDerWaalsContact O-OG1 3.06Å
1534	K	85.8	Confident	86.3	Confident	27 Å²	27	45.8 Å²	45.8	12%	0.117	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-48.6	177.9	-70.6	-169.3	159.2	-168.3	0	111.5	L1000 I1530 M1531 I1532 V1536 T1537 N1538 T1655 I1659	L1000-K1534 HydrophobicContact CD1-CB 4.27Å; L1000-K1534 HydrophobicContact CD1-CD 4.21Å; L1000-K1534 HydrophobicContact CD1-CG 3.57Å; L1000-K1534 HydrophobicContact CD2-CB 4.28Å; L1000-K1534 HydrophobicContact CD2-CD 3.46Å; L1000-K1534 VanDerWaalsContact CD2-CD 3.46Å; L1000-K1534 HydrophobicContact CD2-CG 3.7Å; L1000-K1534 HydrophobicContact CG-CD 4.1Å; L1000-K1534 HydrophobicContact CG-CG 4.02Å; I1530-K1534 HydrophobicContact CG2-CD 4.06Å; I1530-K1534 HydrophobicContact CG2-CG 4.11Å; I1530-K1534 WeakPolarHBondContact O-CB 3.42Å; I1530-K1534 WeakPolarHBondContact O-CG 3.26Å; I1530-K1534 PolarHBondContact O-N 3.01Å; M1531-K1534 PolarHBondContact O-N 3.12Å; I1532-K1534 PolarHBondContact O-N 2.97Å; K1534-V1536 VanDerWaalsContact C-N 3.31Å; K1534-V1536 PolarHBondContact O-N 2.97Å; K1534-T1537 PolarHBondContact O-N 2.75Å; K1534-T1537 PolarHBondContact O-OG1 3.12Å; K1534-N1538 WeakPolarHBondContact O-CA 3.47Å; K1534-N1538 WeakPolarHBondContact O-CB 3.4Å; K1534-N1538 PolarHBondContact O-N 2.96Å; K1534-N1538 PolarHBondContact O-OD1 2.93Å; K1534-T1655 HydrophobicContact CB-CG2 4.3Å; K1534-I1659 HydrophobicContact CB-CD1 3.8Å; K1534-I1659 HydrophobicContact CD-CD1 3.36Å; K1534-I1659 HydrophobicContact CD-CG1 3.98Å; K1534-I1659 HydrophobicContact CG-CD1 4.07Å
1535	M	88.6	Confident	86.6	Confident	26 Å²	26	48.5 Å²	48.5	13%	0.128	26%	0.263	C	S	.	.	H	α-helix	trans	-59.4	-40.5	177	-72.8	168.2	174.6	0	0	112	M1531 I1532 D1539 L1540 F1652 T1655 Y1656	M1531-M1535 HydrophobicContact CG-CE 3.33Å; M1531-M1535 HydrophobicContact CG-CG 4.43Å; M1531-M1535 HydrophobicContact CG-SD 3.79Å; M1531-M1535 WeakPolarHBondContact O-CB 3.14Å; M1531-M1535 VanDerWaalsContact O-CG 3.23Å; M1531-M1535 WeakPolarHBondContact O-CG 3.28Å; M1531-M1535 PolarHBondContact O-N 3.22Å; M1531-M1535 HydrophobicContact SD-CE 3.73Å; I1532-M1535 PolarHBondContact O-N 3.1Å; M1535-D1539 WeakPolarHBondContact O-CB 3.44Å; M1535-D1539 PolarHBondContact O-N 2.5Å; M1535-L1540 PolarHBondContact O-N 3.39Å; M1535-F1652 HydrophobicContact CB-CD1 3.96Å; M1535-F1652 HydrophobicContact CB-CE1 3.92Å; M1535-F1652 WeakPolarHBondContact CE-O 3.36Å; M1535-F1652 HydrophobicContact CG-CD1 4.09Å; M1535-T1655 HydrophobicContact CG-CG2 3.72Å; M1535-Y1656 HydrophobicContact CE-CD2 4.09Å; M1535-Y1656 HydrophobicContact CE-CG 4.31Å
1536	V	87.9	Confident	86.9	Confident	58 Å²	58	48.8 Å²	48.8	35%	0.352	26%	0.264	S	S	.	.	I	π-helix	trans	-65.4	-47.2	177	170.2	0	0	0	0	110.9	I1532 K1534 L1540 I1541	I1532-V1536 HydrophobicContact CG2-CG2 4.26Å; I1532-V1536 WeakPolarHBondContact O-CB 3.24Å; I1532-V1536 WeakPolarHBondContact O-CG2 3.47Å; I1532-V1536 PolarHBondContact O-N 3.45Å; K1534-V1536 VanDerWaalsContact C-N 3.31Å; K1534-V1536 PolarHBondContact O-N 2.97Å; V1536-L1540 HydrophobicContact CG2-CD2 4.18Å; V1536-I1541 WeakPolarHBondContact O-CG1 3.23Å; V1536-I1541 PolarHBondContact O-N 3.29Å; V1536-I1541 VanDerWaalsContact O-N 3.12Å
1537	T	84.8	Confident	87.3	Confident	76 Å²	76	49.5 Å²	49.5	47%	0.466	27%	0.268	S	S	.	.	I	π-helix	trans	-78.8	-38	-176.4	57.5	0	0	0	0	114.4	G1533 K1534	G1533-T1537 WeakPolarHBondContact O-CG2 3.5Å; G1533-T1537 PolarHBondContact O-N 3.29Å; G1533-T1537 PolarHBondContact O-OG1 3.48Å; G1533-T1537 VanDerWaalsContact O-OG1 3.06Å; K1534-T1537 PolarHBondContact O-N 2.75Å; K1534-T1537 PolarHBondContact O-OG1 3.12Å
1538	N	88	Confident	87.6	Confident	11 Å²	11	51.7 Å²	51.7	6%	0.059	28%	0.28	C	S	.	.	I	π-helix	trans	-73.9	-52	-178.5	-72.6	7.5	0	0	0	111.1	L1000 Y1002 K1534 P1542	L1000-N1538 WeakPolarHBondContact CD2-OD1 3.43Å; Y1002-N1538 HydrophobicContact CD1-CB 3.85Å; Y1002-N1538 WeakPolarHBondContact CD1-O 3.27Å; Y1002-N1538 HydrophobicContact CE1-CB 3.57Å; Y1002-N1538 VanDerWaalsContact CE1-O 3.28Å; Y1002-N1538 WeakPolarHBondContact CE1-O 3.45Å; Y1002-N1538 HydrophobicContact CE2-CB 4.31Å; Y1002-N1538 HydrophobicContact CG-CB 4.31Å; K1534-N1538 WeakPolarHBondContact O-CA 3.47Å; K1534-N1538 WeakPolarHBondContact O-CB 3.4Å; K1534-N1538 PolarHBondContact O-N 2.96Å; K1534-N1538 PolarHBondContact O-OD1 2.93Å; N1538-P1542 WeakPolarHBondContact O-CD 3.25Å; N1538-P1542 VanDerWaalsContact O-CG 3.31Å; N1538-P1542 WeakPolarHBondContact O-CG 3.37Å
1539	D	91.8	Very high	87.9	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.016	29%	0.287	C	S	.	.	I	π-helix	trans	-114.5	-50.4	-156.4	-53	-40.4	0	0	0	110.8	Y1002 M1535 P1542 F1543 M1651 F1652 T1655	Y1002-D1539 WeakPolarHBondContact CE1-OD1 3.37Å; Y1002-D1539 VanDerWaalsContact CZ-OD1 3.24Å; Y1002-D1539 PolarHBondContact OH-OD1 3.24Å; M1535-D1539 WeakPolarHBondContact O-CB 3.44Å; M1535-D1539 PolarHBondContact O-N 2.5Å; D1539-P1542 WeakPolarHBondContact O-CD 3.28Å; D1539-F1543 VanDerWaalsContact O-CB 3.24Å; D1539-F1543 WeakPolarHBondContact O-CB 3.44Å; D1539-F1543 PolarHBondContact O-N 2.97Å; D1539-F1543 VanDerWaalsContact O-N 3.12Å; D1539-M1651 HydrophobicContact CB-CB 4.12Å; D1539-F1652 HydrophobicContact CB-CD1 3.92Å; D1539-F1652 HydrophobicContact CB-CE1 3.84Å; D1539-T1655 VanDerWaalsContact OD2-CB 3.31Å; D1539-T1655 WeakPolarHBondContact OD2-CB 3.38Å; D1539-T1655 PolarHBondContact OD2-OG1 3.2Å
1540	L	91.4	Very high	88.2	Confident	46 Å²	46	51.4 Å²	51.4	24%	0.241	29%	0.288	C	S	.	.	I	π-helix	trans	-68.6	-43.5	-174.8	-174.6	64.2	0	0	0	113.1	M1535 V1536 F1543 M1544 L1648 F1652	M1535-L1540 PolarHBondContact O-N 3.39Å; V1536-L1540 HydrophobicContact CG2-CD2 4.18Å; L1540-F1543 PolarHBondContact O-N 3.41Å; L1540-M1544 HydrophobicContact CD1-CE 3.6Å; L1540-M1544 HydrophobicContact CD1-CG 4.09Å; L1540-M1544 HydrophobicContact CG-CG 4.23Å; L1540-M1544 WeakPolarHBondContact O-CB 3.35Å; L1540-M1544 VanDerWaalsContact O-CG 3.28Å; L1540-M1544 WeakPolarHBondContact O-CG 3.44Å; L1540-M1544 PolarHBondContact O-N 3.45Å; L1540-L1648 HydrophobicContact CD1-CD1 4.29Å; L1540-F1652 HydrophobicContact CB-CE1 4.23Å; L1540-F1652 HydrophobicContact CB-CZ 4.11Å; L1540-F1652 HydrophobicContact CD1-CZ 4.12Å
1541	I	89.8	Confident	88.6	Confident	93 Å²	93	50 Å²	50	48%	0.477	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-52.1	-179.2	-72.3	171.2	0	0	0	111.1	V1536 F1543 M1544 I1545	V1536-I1541 WeakPolarHBondContact O-CG1 3.23Å; V1536-I1541 PolarHBondContact O-N 3.29Å; V1536-I1541 VanDerWaalsContact O-N 3.12Å; I1541-F1543 VanDerWaalsContact C-N 3.29Å; I1541-F1543 PolarHBondContact O-N 3.25Å; I1541-M1544 PolarHBondContact O-N 2.73Å; I1541-I1545 HydrophobicContact CG2-CD1 4.37Å; I1541-I1545 WeakPolarHBondContact O-CG1 3.47Å; I1541-I1545 PolarHBondContact O-N 2.98Å
1542	P	88.7	Confident	89	Confident	60 Å²	60	52 Å²	52	39%	0.39	29%	0.293	S	S	.	.	H	α-helix	trans	-59.4	-38.7	175.2	-27	37.6	0	0	0	113.1	N1538 D1539 I1545 I1546	N1538-P1542 WeakPolarHBondContact O-CD 3.25Å; N1538-P1542 VanDerWaalsContact O-CG 3.31Å; N1538-P1542 WeakPolarHBondContact O-CG 3.37Å; D1539-P1542 WeakPolarHBondContact O-CD 3.28Å; P1542-I1545 PolarHBondContact O-N 3.33Å; P1542-I1546 WeakPolarHBondContact O-CG1 3.39Å; P1542-I1546 PolarHBondContact O-N 3.35Å
1543	F	90.7	Very high	89.2	Confident	6 Å²	6	49.7 Å²	49.7	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-44	176.9	-179.9	-95.2	0	0	0	112.8	D1539 L1540 I1541 I1545 I1546 L1547 M1644 L1648	D1539-F1543 VanDerWaalsContact O-CB 3.24Å; D1539-F1543 WeakPolarHBondContact O-CB 3.44Å; D1539-F1543 PolarHBondContact O-N 2.97Å; D1539-F1543 VanDerWaalsContact O-N 3.12Å; L1540-F1543 PolarHBondContact O-N 3.41Å; I1541-F1543 VanDerWaalsContact C-N 3.29Å; I1541-F1543 PolarHBondContact O-N 3.25Å; F1543-I1545 VanDerWaalsContact C-N 3.26Å; F1543-I1545 PolarHBondContact O-N 3.42Å; F1543-I1546 PolarHBondContact O-N 3.31Å; F1543-I1546 VanDerWaalsContact O-N 3.16Å; F1543-L1547 HydrophobicContact CE1-CD2 4.36Å; F1543-L1547 PolarHBondContact O-N 3.42Å; F1543-M1644 HydrophobicContact CE2-CB 4Å; F1543-M1644 WeakPolarHBondContact CE2-O 3.41Å; F1543-M1644 HydrophobicContact CE2-SD 4.25Å; F1543-M1644 HydrophobicContact CZ-CB 3.84Å; F1543-M1644 WeakPolarHBondContact CZ-O 3.18Å; F1543-L1648 HydrophobicContact CB-CD1 4.05Å; F1543-L1648 HydrophobicContact CD1-CB 4.44Å; F1543-L1648 HydrophobicContact CD1-CD1 3.79Å; F1543-L1648 HydrophobicContact CD1-CD2 4.06Å; F1543-L1648 HydrophobicContact CD1-CG 4.31Å; F1543-L1648 HydrophobicContact CD2-CB 4.14Å; F1543-L1648 HydrophobicContact CD2-CD1 4.2Å; F1543-L1648 HydrophobicContact CE1-CB 4.15Å; F1543-L1648 HydrophobicContact CE1-CD1 4.27Å; F1543-L1648 HydrophobicContact CE1-CD2 3.8Å; F1543-L1648 HydrophobicContact CE1-CG 4.29Å; F1543-L1648 HydrophobicContact CE2-CB 3.85Å; F1543-L1648 HydrophobicContact CG-CB 4.42Å; F1543-L1648 HydrophobicContact CG-CD1 3.74Å; F1543-L1648 HydrophobicContact CZ-CB 3.83Å; F1543-L1648 HydrophobicContact CZ-CD2 4.27Å; F1543-L1648 HydrophobicContact CZ-CG 4.47Å
1544	M	88	Confident	89.6	Confident	87 Å²	87	49 Å²	49	43%	0.429	28%	0.279	S	S	.	.	H	α-helix	trans	-63.5	-31.4	177.9	-75.2	-67.1	160.9	0	0	112.5	L1540 I1541 L1547 T1548	L1540-M1544 HydrophobicContact CD1-CE 3.6Å; L1540-M1544 HydrophobicContact CD1-CG 4.09Å; L1540-M1544 HydrophobicContact CG-CG 4.23Å; L1540-M1544 WeakPolarHBondContact O-CB 3.35Å; L1540-M1544 VanDerWaalsContact O-CG 3.28Å; L1540-M1544 WeakPolarHBondContact O-CG 3.44Å; L1540-M1544 PolarHBondContact O-N 3.45Å; I1541-M1544 PolarHBondContact O-N 2.73Å; M1544-L1547 HydrophobicContact SD-CD2 4.18Å; M1544-T1548 WeakPolarHBondContact O-CB 3.15Å; M1544-T1548 PolarHBondContact O-N 2.88Å; M1544-T1548 PolarHBondContact O-OG1 3.26Å
1545	I	91.2	Very high	89.8	Confident	107 Å²	107	48 Å²	48	55%	0.549	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-48.3	172.8	-66	168.2	0	0	0	110.1	I1541 P1542 F1543 L1547 T1548 V1549	I1541-I1545 HydrophobicContact CG2-CD1 4.37Å; I1541-I1545 WeakPolarHBondContact O-CG1 3.47Å; I1541-I1545 PolarHBondContact O-N 2.98Å; P1542-I1545 PolarHBondContact O-N 3.33Å; F1543-I1545 VanDerWaalsContact C-N 3.26Å; F1543-I1545 PolarHBondContact O-N 3.42Å; I1545-L1547 VanDerWaalsContact C-N 3.35Å; I1545-L1547 PolarHBondContact O-N 3.49Å; I1545-T1548 PolarHBondContact O-N 3.14Å; I1545-V1549 WeakPolarHBondContact O-CG2 3.4Å; I1545-V1549 PolarHBondContact O-N 3.24Å; I1545-V1549 VanDerWaalsContact O-N 3.1Å
1546	I	90.6	Very high	89.9	Confident	86 Å²	86	50.2 Å²	50.2	44%	0.441	29%	0.291	S	S	.	.	H	α-helix	trans	-61	-44.8	178	-63.3	167.1	0	0	0	110.7	P1542 F1543 T1548 V1549 I1550 M1644	P1542-I1546 WeakPolarHBondContact O-CG1 3.39Å; P1542-I1546 PolarHBondContact O-N 3.35Å; F1543-I1546 PolarHBondContact O-N 3.31Å; F1543-I1546 VanDerWaalsContact O-N 3.16Å; I1546-T1548 VanDerWaalsContact C-N 3.33Å; I1546-T1548 PolarHBondContact O-N 3.4Å; I1546-V1549 PolarHBondContact O-N 3.28Å; I1546-I1550 HydrophobicContact CG2-CD1 4.04Å; I1546-I1550 PolarHBondContact O-N 2.94Å; I1546-M1644 HydrophobicContact CG2-SD 4.03Å
1547	L	89.5	Confident	90	Very high	16 Å²	16	49.1 Å²	49.1	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-40.2	178.3	-174	63.7	0	0	0	112.1	F1543 M1544 I1545 V1549 I1550 M1551 M1599 T1640	F1543-L1547 HydrophobicContact CE1-CD2 4.36Å; F1543-L1547 PolarHBondContact O-N 3.42Å; M1544-L1547 HydrophobicContact SD-CD2 4.18Å; I1545-L1547 VanDerWaalsContact C-N 3.35Å; I1545-L1547 PolarHBondContact O-N 3.49Å; L1547-V1549 PolarHBondContact O-N 3.04Å; L1547-I1550 PolarHBondContact O-N 3.37Å; L1547-M1551 VanDerWaalsContact O-CB 3.27Å; L1547-M1551 WeakPolarHBondContact O-CB 3.48Å; L1547-M1551 PolarHBondContact O-N 3.29Å; L1547-M1599 HydrophobicContact CD1-SD 3.78Å; L1547-M1599 HydrophobicContact CD2-CE 4.28Å; L1547-M1599 HydrophobicContact CD2-SD 4.17Å; L1547-M1599 HydrophobicContact CG-SD 4.39Å; L1547-T1640 HydrophobicContact CD1-CG2 4.45Å
1548	T	88	Confident	90.1	Very high	57 Å²	57	46.2 Å²	46.2	35%	0.35	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-40.8	177.2	-57.8	0	0	0	0	111.6	M1544 I1545 I1546 M1551 V1552	M1544-T1548 WeakPolarHBondContact O-CB 3.15Å; M1544-T1548 PolarHBondContact O-N 2.88Å; M1544-T1548 PolarHBondContact O-OG1 3.26Å; I1545-T1548 PolarHBondContact O-N 3.14Å; I1546-T1548 VanDerWaalsContact C-N 3.33Å; I1546-T1548 PolarHBondContact O-N 3.4Å; T1548-M1551 HydrophobicContact CG2-CE 4.36Å; T1548-M1551 PolarHBondContact O-N 3.46Å; T1548-V1552 HydrophobicContact CG2-CG2 4.15Å; T1548-V1552 WeakPolarHBondContact O-CB 3.36Å; T1548-V1552 VanDerWaalsContact O-CG2 3.23Å; T1548-V1552 WeakPolarHBondContact O-CG2 3.49Å; T1548-V1552 PolarHBondContact O-N 3.33Å
1549	V	91.7	Very high	90	Very high	103 Å²	103	47.1 Å²	47.1	62%	0.624	28%	0.275	S	S	*	.	H	α-helix	trans	-61.7	-46.6	177.4	172.5	0	0	0	0	111.3	I1545 I1546 L1547 G1553	I1545-V1549 WeakPolarHBondContact O-CG2 3.4Å; I1545-V1549 PolarHBondContact O-N 3.24Å; I1545-V1549 VanDerWaalsContact O-N 3.1Å; I1546-V1549 PolarHBondContact O-N 3.28Å; L1547-V1549 PolarHBondContact O-N 3.04Å; V1549-G1553 PolarHBondContact O-N 3.37Å
1550	I	90.5	Very high	89.7	Confident	40 Å²	40	50.3 Å²	50.3	21%	0.205	30%	0.298	C	S	.	.	H	α-helix	trans	-65.2	-46.4	179.4	-65.2	163.6	0	0	0	110.8	I1546 L1547 G1553 Y1554 Y1636 L1639 M1644	I1546-I1550 HydrophobicContact CG2-CD1 4.04Å; I1546-I1550 PolarHBondContact O-N 2.94Å; L1547-I1550 PolarHBondContact O-N 3.37Å; I1550-G1553 PolarHBondContact O-N 3.05Å; I1550-Y1554 PolarHBondContact O-N 2.93Å; I1550-Y1636 HydrophobicContact CG2-CD2 4.36Å; I1550-Y1636 HydrophobicContact CG2-CE2 4.18Å; I1550-L1639 HydrophobicContact CD1-CD2 3.87Å; I1550-L1639 HydrophobicContact CG1-CD2 4.35Å; I1550-L1639 HydrophobicContact CG2-CD2 3.56Å; I1550-M1644 HydrophobicContact CD1-CE 4.2Å; I1550-M1644 HydrophobicContact CD1-CG 4.17Å; I1550-M1644 HydrophobicContact CD1-SD 3.85Å
1551	M	90.5	Very high	89.4	Confident	6 Å²	6	50.2 Å²	50.2	3%	0.03	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-46.7	179.4	177.6	-175.3	47.3	0	0	111.6	L1547 T1548 G1553 Y1554 A1555 Y1592 A1595 Y1596	L1547-M1551 VanDerWaalsContact O-CB 3.27Å; L1547-M1551 WeakPolarHBondContact O-CB 3.48Å; L1547-M1551 PolarHBondContact O-N 3.29Å; T1548-M1551 HydrophobicContact CG2-CE 4.36Å; T1548-M1551 PolarHBondContact O-N 3.46Å; M1551-G1553 VanDerWaalsContact C-N 3.32Å; M1551-G1553 PolarHBondContact O-N 3.32Å; M1551-Y1554 PolarHBondContact O-N 3.44Å; M1551-A1555 WeakPolarHBondContact O-CB 3.46Å; M1551-A1555 PolarHBondContact O-N 3.33Å; M1551-Y1592 HydrophobicContact CE-CD2 3.96Å; M1551-Y1592 HydrophobicContact CE-CE1 4.35Å; M1551-Y1592 HydrophobicContact CE-CE2 3.18Å; M1551-Y1592 VanDerWaalsContact CE-CZ 3.42Å; M1551-Y1592 WeakPolarHBondContact CE-OH 3.33Å; M1551-Y1592 HydrophobicContact SD-CD2 4.45Å; M1551-Y1592 HydrophobicContact SD-CE2 4.09Å; M1551-A1595 HydrophobicContact CG-CB 3.89Å; M1551-Y1596 HydrophobicContact SD-CD2 4.33Å
1552	V	90.5	Very high	88.9	Confident	56 Å²	56	46.1 Å²	46.1	34%	0.339	28%	0.278	S	S	.	.	H	α-helix	trans	-62.7	-40.7	177.3	171	0	0	0	0	110.7	T1548 Y1554 A1555 V1556	T1548-V1552 HydrophobicContact CG2-CG2 4.15Å; T1548-V1552 WeakPolarHBondContact O-CB 3.36Å; T1548-V1552 VanDerWaalsContact O-CG2 3.23Å; T1548-V1552 WeakPolarHBondContact O-CG2 3.49Å; T1548-V1552 PolarHBondContact O-N 3.33Å; V1552-Y1554 PolarHBondContact O-N 3.2Å; V1552-A1555 PolarHBondContact O-N 2.96Å; V1552-V1556 HydrophobicContact CG1-CG2 4.06Å; V1552-V1556 WeakPolarHBondContact O-CB 3.33Å; V1552-V1556 VanDerWaalsContact O-CG2 3.24Å; V1552-V1556 WeakPolarHBondContact O-CG2 3.49Å; V1552-V1556 PolarHBondContact O-N 3.46Å
1553	G	91.2	Very high	88.3	Confident	45 Å²	45	46.1 Å²	46.1	46%	0.464	27%	0.27	S	S	.	.	H	α-helix	trans	-58.4	-48.2	176.3	0	0	0	0	0	112.8	V1549 I1550 M1551 A1557	V1549-G1553 PolarHBondContact O-N 3.37Å; I1550-G1553 PolarHBondContact O-N 3.05Å; M1551-G1553 VanDerWaalsContact C-N 3.32Å; M1551-G1553 PolarHBondContact O-N 3.32Å; G1553-A1557 WeakPolarHBondContact O-CB 3.26Å; G1553-A1557 PolarHBondContact O-N 3.49Å
1554	Y	92.7	Very high	87.5	Confident	20 Å²	20	49.3 Å²	49.3	8%	0.078	29%	0.292	C	S	.	.	H	α-helix	trans	-65.9	-44.2	175.2	167.7	-104.9	0	0	0	112.2	I1550 M1551 V1552 V1556 A1557 A1558 A1595 Q1598 M1632 L1633 Y1636	I1550-Y1554 PolarHBondContact O-N 2.93Å; M1551-Y1554 PolarHBondContact O-N 3.44Å; V1552-Y1554 PolarHBondContact O-N 3.2Å; Y1554-V1556 PolarHBondContact O-N 2.99Å; Y1554-A1557 PolarHBondContact O-N 3Å; Y1554-A1558 HydrophobicContact CE2-CB 4.26Å; Y1554-A1558 WeakPolarHBondContact O-CB 3.31Å; Y1554-A1558 PolarHBondContact O-N 3.47Å; Y1554-A1595 HydrophobicContact CD1-CB 3.98Å; Y1554-A1595 HydrophobicContact CE1-CB 4.22Å; Y1554-Q1598 VanDerWaalsContact CZ-OE1 3.3Å; Y1554-Q1598 PolarHBondContact OH-OE1 3.12Å; Y1554-M1632 HydrophobicContact CE2-CB 4.24Å; Y1554-L1633 WeakPolarHBondContact OH-CD1 3.36Å; Y1554-Y1636 AromaticContact CD1-CD1 3.66Å; Y1554-Y1636 HydrophobicContact CD1-CD1 3.66Å; Y1554-Y1636 AromaticContact CD1-CD2 3.92Å; Y1554-Y1636 HydrophobicContact CD1-CD2 3.92Å; Y1554-Y1636 AromaticContact CD1-CE1 3.79Å; Y1554-Y1636 HydrophobicContact CD1-CE1 3.79Å; Y1554-Y1636 HydrophobicContact CD1-CE2 4.04Å; Y1554-Y1636 AromaticContact CD1-CG 3.73Å; Y1554-Y1636 HydrophobicContact CD1-CG 3.73Å; Y1554-Y1636 AromaticContact CD1-CZ 3.98Å; Y1554-Y1636 HydrophobicContact CD2-CD1 4.42Å; Y1554-Y1636 HydrophobicContact CD2-CD2 4.29Å; Y1554-Y1636 AromaticContact CD2-CG 3.89Å; Y1554-Y1636 HydrophobicContact CD2-CG 3.89Å; Y1554-Y1636 AromaticContact CE1-CD1 3.69Å; Y1554-Y1636 HydrophobicContact CE1-CD1 3.69Å; Y1554-Y1636 AromaticContact CE1-CE1 3.94Å; Y1554-Y1636 HydrophobicContact CE1-CE1 3.94Å; Y1554-Y1636 HydrophobicContact CE1-CG 4.11Å; Y1554-Y1636 HydrophobicContact CE2-CD1 4.45Å; Y1554-Y1636 HydrophobicContact CE2-CG 4.27Å; Y1554-Y1636 HydrophobicContact CG-CD1 4.05Å; Y1554-Y1636 AromaticContact CG-CD2 3.67Å; Y1554-Y1636 HydrophobicContact CG-CD2 3.67Å; Y1554-Y1636 HydrophobicContact CG-CE1 4.49Å; Y1554-Y1636 HydrophobicContact CG-CE2 4.16Å; Y1554-Y1636 AromaticContact CG-CG 3.61Å; Y1554-Y1636 HydrophobicContact CG-CG 3.61Å
1555	A	89.7	Confident	86.6	Confident	5 Å²	5	52.2 Å²	52.2	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-63.9	-42.9	-176.4	0	0	0	0	0	112.4	M1551 V1552 Q1559 M1591 A1595	M1551-A1555 WeakPolarHBondContact O-CB 3.46Å; M1551-A1555 PolarHBondContact O-N 3.33Å; V1552-A1555 PolarHBondContact O-N 2.96Å; A1555-Q1559 VanDerWaalsContact O-CB 3.26Å; A1555-Q1559 WeakPolarHBondContact O-CB 3.44Å; A1555-Q1559 PolarHBondContact O-N 3.19Å; A1555-M1591 HydrophobicContact CB-CE 4.32Å; A1555-M1591 HydrophobicContact CB-CG 3.36Å; A1555-M1591 HydrophobicContact CB-SD 4.17Å; A1555-A1595 HydrophobicContact CB-CB 3.47Å; A1555-A1595 VanDerWaalsContact CB-CB 3.47Å
1556	V	90.4	Very high	85.5	Confident	74 Å²	74	47.9 Å²	47.9	45%	0.448	29%	0.29	S	S	.	.	H	α-helix	trans	-64.7	-43.2	175.8	173.1	0	0	0	0	110.8	V1552 Y1554 S1560 M1591	V1552-V1556 HydrophobicContact CG1-CG2 4.06Å; V1552-V1556 WeakPolarHBondContact O-CB 3.33Å; V1552-V1556 VanDerWaalsContact O-CG2 3.24Å; V1552-V1556 WeakPolarHBondContact O-CG2 3.49Å; V1552-V1556 PolarHBondContact O-N 3.46Å; Y1554-V1556 PolarHBondContact O-N 2.99Å; V1556-S1560 VanDerWaalsContact O-CB 3.25Å; V1556-S1560 WeakPolarHBondContact O-CB 3.48Å; V1556-S1560 PolarHBondContact O-N 3.46Å; V1556-S1560 PolarHBondContact O-OG 2.08Å; V1556-M1591 HydrophobicContact CB-SD 4.29Å; V1556-M1591 HydrophobicContact CG2-CE 3.87Å; V1556-M1591 HydrophobicContact CG2-SD 3.52Å; V1556-M1591 VanDerWaalsContact CG2-SD 3.52Å
1557	A	90.4	Very high	84.1	Confident	35 Å²	35	47.4 Å²	47.4	29%	0.289	29%	0.289	S	S	.	.	H	α-helix	trans	-63.8	-47.5	177.5	0	0	0	0	0	111.7	G1553 Y1554 S1560 I1561	G1553-A1557 WeakPolarHBondContact O-CB 3.26Å; G1553-A1557 PolarHBondContact O-N 3.49Å; Y1554-A1557 PolarHBondContact O-N 3Å; A1557-S1560 PolarHBondContact O-OG 3.34Å; A1557-I1561 WeakPolarHBondContact O-CB 3.31Å; A1557-I1561 VanDerWaalsContact O-CD1 3.3Å; A1557-I1561 WeakPolarHBondContact O-CD1 3.38Å; A1557-I1561 WeakPolarHBondContact O-CG1 3.17Å; A1557-I1561 PolarHBondContact O-N 3.5Å
1558	A	87.6	Confident	82.7	Confident	15 Å²	15	50.9 Å²	50.9	12%	0.124	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-45.7	-179.9	0	0	0	0	0	112.2	Y1554 I1561 A1562 V1629	Y1554-A1558 HydrophobicContact CE2-CB 4.26Å; Y1554-A1558 WeakPolarHBondContact O-CB 3.31Å; Y1554-A1558 PolarHBondContact O-N 3.47Å; A1558-I1561 PolarHBondContact O-N 2.98Å; A1558-A1562 VanDerWaalsContact O-CB 3.26Å; A1558-A1562 WeakPolarHBondContact O-CB 3.27Å; A1558-A1562 PolarHBondContact O-N 3.49Å; A1558-V1629 HydrophobicContact CB-CG1 4.19Å
1559	Q	86.2	Confident	80.9	Confident	29 Å²	29	51.4 Å²	51.4	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-67.9	-39.2	-178.7	-170.1	67.2	7.1	0	0	112.4	A1555 A1562 Y1563 M1591	A1555-Q1559 VanDerWaalsContact O-CB 3.26Å; A1555-Q1559 WeakPolarHBondContact O-CB 3.44Å; A1555-Q1559 PolarHBondContact O-N 3.19Å; Q1559-A1562 PolarHBondContact O-N 3Å; Q1559-Y1563 PolarHBondContact O-N 3.45Å; Q1559-M1591 HydrophobicContact CB-CG 4.32Å; Q1559-M1591 HydrophobicContact CG-CB 4.48Å
1560	S	85	Confident	78.9	Confident	71 Å²	71	51.3 Å²	51.3	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-68.2	-34.8	178.7	59.9	0	0	0	0	113	V1556 A1557	V1556-S1560 VanDerWaalsContact O-CB 3.25Å; V1556-S1560 WeakPolarHBondContact O-CB 3.48Å; V1556-S1560 PolarHBondContact O-N 3.46Å; V1556-S1560 PolarHBondContact O-OG 2.08Å; A1557-S1560 PolarHBondContact O-OG 3.34Å
1561	I	85.2	Confident	77.1	Confident	43 Å²	43	54.5 Å²	54.5	22%	0.221	31%	0.312	C	S	.	.	H	α-helix	trans	-75.1	-37.8	176.1	-65.7	166.6	0	0	0	110.9	A1557 A1558 T1622 L1628 V1629	A1557-I1561 WeakPolarHBondContact O-CB 3.31Å; A1557-I1561 VanDerWaalsContact O-CD1 3.3Å; A1557-I1561 WeakPolarHBondContact O-CD1 3.38Å; A1557-I1561 WeakPolarHBondContact O-CG1 3.17Å; A1557-I1561 PolarHBondContact O-N 3.5Å; A1558-I1561 PolarHBondContact O-N 2.98Å; I1561-T1622 PolarHBondContact O-OG1 3.25Å; I1561-L1628 HydrophobicContact CD1-CD2 3.96Å; I1561-L1628 HydrophobicContact CG2-CD2 4.27Å; I1561-V1629 HydrophobicContact CB-CG2 4.24Å; I1561-V1629 HydrophobicContact CG2-CG2 3.82Å
1562	A	78.3	Confident	75.2	Confident	8 Å²	8	59.9 Å²	59.9	7%	0.066	34%	0.34	C	S	.	.	H	α-helix	trans	-74.9	-44.4	-178.3	0	0	0	0	0	113.5	A1558 Q1559	A1558-A1562 VanDerWaalsContact O-CB 3.26Å; A1558-A1562 WeakPolarHBondContact O-CB 3.27Å; A1558-A1562 PolarHBondContact O-N 3.49Å; Q1559-A1562 PolarHBondContact O-N 3Å
1563	Y	77.4	Confident	73.2	Confident	60 Å²	60	66.1 Å²	66.1	24%	0.235	37%	0.368	C	S	.	.	S	Bend	trans	-130.2	81.6	-172.4	-58.4	-71	0	0	0	112.1	Q1559 N1565 G1566 M1619	Q1559-Y1563 PolarHBondContact O-N 3.45Å; Y1563-N1565 PolarHBondContact O-N 3.22Å; Y1563-G1566 PolarHBondContact O-N 3.12Å; Y1563-M1619 HydrophobicContact CD1-CE 4.27Å; Y1563-M1619 HydrophobicContact CE1-CB 4.13Å; Y1563-M1619 HydrophobicContact CE1-CE 3.64Å; Y1563-M1619 HydrophobicContact CE2-CE 4.2Å
1564	P	73.7	Confident	71.3	Confident	73 Å²	73	67.9 Å²	67.9	47%	0.474	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-60.8	129	178.9	25.3	-33.7	0	0	0	110.8	G1566 T1622	P1564-G1566 PolarHBondContact O-N 2.94Å; P1564-G1566 VanDerWaalsContact O-N 3.12Å; P1564-T1622 VanDerWaalsContact CD-CG2 3.49Å; P1564-T1622 HydrophobicContact CG-CG2 3.78Å
1565	N	69.4	Low	69.5	Low	147 Å²	147	75.3 Å²	75.3	79%	0.786	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	59.5	11.8	179.4	-60.3	-21.9	0	0	0	116.9	Y1563 L1567	Y1563-N1565 PolarHBondContact O-N 3.22Å; N1565-L1567 HydrophobicContact CB-CD1 4.3Å; N1565-L1567 HydrophobicContact CB-CG 4.06Å; N1565-L1567 WeakPolarHBondContact O-CD2 3.4Å; N1565-L1567 PolarHBondContact O-N 3.44Å
1566	G	67.7	Low	67.8	Low	16 Å²	16	81.9 Å²	81.9	17%	0.165	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	66.2	28.5	174.4	0	0	0	0	0	115.9	Y1563 P1564 M1582	Y1563-G1566 PolarHBondContact O-N 3.12Å; P1564-G1566 PolarHBondContact O-N 2.94Å; P1564-G1566 VanDerWaalsContact O-N 3.12Å; G1566-M1582 PolarHBondContact O-N 3.12Å
1567	L	60.6	Low	66.1	Low	77 Å²	77	80.5 Å²	80.5	40%	0.403	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	144.8	-173.6	-51.4	-177.2	0	0	0	113	N1565 I1579 H1581	N1565-L1567 HydrophobicContact CB-CD1 4.3Å; N1565-L1567 HydrophobicContact CB-CG 4.06Å; N1565-L1567 WeakPolarHBondContact O-CD2 3.4Å; N1565-L1567 PolarHBondContact O-N 3.44Å; L1567-I1579 HydrophobicContact CB-CG2 4.16Å; L1567-I1579 HydrophobicContact CD1-CG2 4.43Å; L1567-I1579 HydrophobicContact CD2-CG2 4.19Å; L1567-I1579 HydrophobicContact CG-CG2 4.49Å; L1567-H1581 WeakPolarHBondContact CD2-CE1 3.42Å; L1567-H1581 WeakPolarHBondContact CD2-ND1 3.14Å
1568	F	60.8	Low	64.2	Low	88 Å²	88	85.6 Å²	85.6	39%	0.386	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151.5	170.9	68.1	-83.2	0	0	0	114.7	K1580	F1568-K1580 HydrophobicContact CD1-CB 4.4Å; F1568-K1580 WeakPolarHBondContact CD1-O 3.28Å; F1568-K1580 HydrophobicContact CD2-CB 4.41Å; F1568-K1580 HydrophobicContact CE1-CB 3.89Å; F1568-K1580 HydrophobicContact CE2-CB 3.91Å; F1568-K1580 HydrophobicContact CZ-CB 3.62Å; F1568-K1580 PolarHBondContact N-O 3.44Å; F1568-K1580 PolarHBondContact O-N 2.89Å
1569	T	50.2	Low	62.7	Low	69 Å²	69	89.8 Å²	89.8	42%	0.423	48%	0.475	S	S	.	.			trans	-159.8	142.2	-178.6	48.8	0	0	0	0	109.1	I1579	T1569-I1579 HydrophobicContact CG2-CB 4.2Å; T1569-I1579 HydrophobicContact CG2-CG1 3.84Å
1570	K	50.1	Low	61.4	Low	100 Å²	100	93.2 Å²	93.2	44%	0.435	49%	0.49	S	S	.	.			trans	-73.3	138.8	171.9	-176.8	177.3	179.5	64.7	0	112.1	N1572 H1618	K1570-N1572 PolarHBondContact O-N 3.07Å; K1570-H1618 HydrophobicContact CB-CB 4.12Å; K1570-H1618 VanDerWaalsContact CD-CD2 3.42Å; K1570-H1618 WeakPolarHBondContact CD-CD2 3.28Å; K1570-H1618 HydrophobicContact CG-CB 4.12Å; K1570-H1618 PolarHBondContact NZ-CD2 2.74Å; K1570-H1618 PolarHBondContact NZ-CE1 3.26Å; K1570-H1618 PolarHBondContact NZ-ND1 3.05Å; K1570-H1618 PolarHBondContact NZ-NE2 3.32Å
1571	E	51.4	Low	60.4	Low	108 Å²	108	96.4 Å²	96.4	51%	0.505	50%	0.496	S	S	.	.	S	Bend	trans	-12.3	-16.3	160.5	-65.3	174.4	134.7	0	0	122.1
1572	N	49.9	Very low	59.6	Low	118 Å²	118	96.5 Å²	96.5	63%	0.631	50%	0.497	S	S	*	.			trans	-103.5	85.2	177.7	-65.5	1.6	0	0	0	109.5	K1570 T1574	K1570-N1572 PolarHBondContact O-N 3.07Å; N1572-T1574 PolarHBondContact O-N 3.29Å
1573	M	48.6	Very low	59.6	Low	188 Å²	188	99.8 Å²	99.8	93%	0.926	52%	0.516	S	S	*	.			trans	-61	120.3	-179.8	-164.3	173.9	-166.5	0	0	111.2
1574	T	51.1	Low	59.7	Low	82 Å²	82	104.8 Å²	104.8	50%	0.503	54%	0.539	S	S	.	.			trans	-144	167.8	177.9	64	0	0	0	0	111.8	N1572 N1576 S1577	N1572-T1574 PolarHBondContact O-N 3.29Å; T1574-N1576 PolarHBondContact O-N 3.12Å; T1574-N1576 VanDerWaalsContact O-N 3.12Å; T1574-N1576 PolarHBondContact OG1-N 3Å; T1574-S1577 PolarHBondContact N-OG 3.13Å; T1574-S1577 PolarHBondContact O-N 3.06Å; T1574-S1577 PolarHBondContact O-OG 3.39Å; T1574-S1577 PolarHBondContact OG1-OG 2.9Å
1575	L	54.8	Low	60.1	Low	175 Å²	175	104.4 Å²	104.4	92%	0.916	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-8.1	171	-172.5	56.6	0	0	0	113.5
1576	N	55.2	Low	60.5	Low	143 Å²	143	101.4 Å²	101.4	77%	0.765	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	21.5	-177.9	-58.2	98.5	0	0	0	112.6	T1574 E1578	T1574-N1576 PolarHBondContact O-N 3.12Å; T1574-N1576 VanDerWaalsContact O-N 3.12Å; T1574-N1576 PolarHBondContact OG1-N 3Å; N1576-E1578 PolarHBondContact O-N 2.88Å
1577	S	54.3	Low	61.1	Low	45 Å²	45	103 Å²	103	32%	0.315	53%	0.531	S	S	.	.			trans	-78	97.8	-178.1	-49.1	0	0	0	0	111.1	T1574 I1579	T1574-S1577 PolarHBondContact N-OG 3.13Å; T1574-S1577 PolarHBondContact O-N 3.06Å; T1574-S1577 PolarHBondContact O-OG 3.39Å; T1574-S1577 PolarHBondContact OG1-OG 2.9Å; S1577-I1579 PolarHBondContact O-N 3.36Å; S1577-I1579 VanDerWaalsContact O-N 3.12Å
1578	E	50.1	Low	62.2	Low	142 Å²	142	103 Å²	103	66%	0.664	53%	0.53	S	S	*	.			trans	-66.5	109.9	169	-78.5	-172.5	159.5	0	0	110.1	N1576 K1580	N1576-E1578 PolarHBondContact O-N 2.88Å; E1578-K1580 WeakPolarHBondContact OE2-CE 3.3Å; E1578-K1580 IonicContact OE2-NZ 3.76Å; E1578-K1580 PolarHBondContact OE2-NZ 3.24Å
1579	I	57.2	Low	63.3	Low	103 Å²	103	105.8 Å²	105.8	53%	0.528	54%	0.543	S	S	.	.			trans	-69.5	131.2	168.1	-57.9	166.8	0	0	0	108	L1567 T1569 S1577	L1567-I1579 HydrophobicContact CB-CG2 4.16Å; L1567-I1579 HydrophobicContact CD1-CG2 4.43Å; L1567-I1579 HydrophobicContact CD2-CG2 4.19Å; L1567-I1579 HydrophobicContact CG-CG2 4.49Å; T1569-I1579 HydrophobicContact CG2-CB 4.2Å; T1569-I1579 HydrophobicContact CG2-CG1 3.84Å; S1577-I1579 PolarHBondContact O-N 3.36Å; S1577-I1579 VanDerWaalsContact O-N 3.12Å
1580	K	58.9	Low	64.6	Low	101 Å²	101	104.2 Å²	104.2	44%	0.439	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145	179.5	-57.5	-161	178	-166.4	0	110.7	F1568 E1578	F1568-K1580 HydrophobicContact CD1-CB 4.4Å; F1568-K1580 WeakPolarHBondContact CD1-O 3.28Å; F1568-K1580 HydrophobicContact CD2-CB 4.41Å; F1568-K1580 HydrophobicContact CE1-CB 3.89Å; F1568-K1580 HydrophobicContact CE2-CB 3.91Å; F1568-K1580 HydrophobicContact CZ-CB 3.62Å; F1568-K1580 PolarHBondContact N-O 3.44Å; F1568-K1580 PolarHBondContact O-N 2.89Å; E1578-K1580 WeakPolarHBondContact OE2-CE 3.3Å; E1578-K1580 IonicContact OE2-NZ 3.76Å; E1578-K1580 PolarHBondContact OE2-NZ 3.24Å
1581	H	62.4	Low	66.3	Low	138 Å²	138	100.9 Å²	100.9	64%	0.639	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	133.8	-175.7	-72.5	-86.4	0	0	0	109.1	L1567	L1567-H1581 WeakPolarHBondContact CD2-CE1 3.42Å; L1567-H1581 WeakPolarHBondContact CD2-ND1 3.14Å
1582	M	69.6	Low	68	Low	46 Å²	46	100.5 Å²	100.5	23%	0.227	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-70.9	136.3	168.5	-159	161.5	160.7	0	0	108.8	G1566 D1586 I1587	G1566-M1582 PolarHBondContact O-N 3.12Å; M1582-D1586 HydrophobicContact CE-CB 4.05Å; M1582-D1586 WeakPolarHBondContact CE-O 3.4Å; M1582-D1586 HydrophobicContact CG-CB 3.85Å; M1582-I1587 HydrophobicContact CB-CD1 4.17Å; M1582-I1587 HydrophobicContact CB-CG1 3.79Å; M1582-I1587 HydrophobicContact CE-CG1 4.45Å; M1582-I1587 HydrophobicContact CG-CG1 3.77Å; M1582-I1587 HydrophobicContact SD-CG1 4.13Å
1583	T	77.2	Confident	69.6	Low	77 Å²	77	96.6 Å²	96.6	47%	0.472	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-68.1	150.1	178.4	75.9	0	0	0	0	109.6	A1585 D1586 I1587	T1583-A1585 PolarHBondContact O-N 3.22Å; T1583-D1586 PolarHBondContact O-N 3.36Å; T1583-D1586 PolarHBondContact OG1-N 3.19Å; T1583-D1586 PolarHBondContact OG1-OD2 3.49Å; T1583-I1587 WeakPolarHBondContact O-CG1 3.44Å; T1583-I1587 PolarHBondContact O-N 3.04Å
1584	F	80.9	Confident	71.3	Confident	164 Å²	164	90.2 Å²	90.2	72%	0.719	47%	0.467	S	S	*	.	H	α-helix	trans	-55.4	-36.2	179.5	179.3	-104.1	0	0	0	112.5	I1587 I1588	F1584-I1587 PolarHBondContact O-N 3.31Å; F1584-I1588 HydrophobicContact CD1-CD1 3.96Å; F1584-I1588 HydrophobicContact CE1-CD1 3.3Å; F1584-I1588 HydrophobicContact CE1-CG1 4.35Å; F1584-I1588 HydrophobicContact CE2-CD1 3.96Å; F1584-I1588 HydrophobicContact CE2-CG1 4.43Å; F1584-I1588 HydrophobicContact CZ-CD1 3.32Å; F1584-I1588 HydrophobicContact CZ-CG1 4.25Å; F1584-I1588 PolarHBondContact O-N 3.28Å; F1584-I1588 VanDerWaalsContact O-N 3.1Å
1585	A	80.5	Confident	73.1	Confident	66 Å²	66	86.4 Å²	86.4	55%	0.545	44%	0.444	S	S	.	.	H	α-helix	trans	-65.3	-43.2	176.1	0	0	0	0	0	112	T1583 I1588 F1589	T1583-A1585 PolarHBondContact O-N 3.22Å; A1585-I1588 PolarHBondContact O-N 3.03Å; A1585-F1589 VanDerWaalsContact O-CB 3.26Å; A1585-F1589 WeakPolarHBondContact O-CB 3.34Å; A1585-F1589 PolarHBondContact O-N 3.4Å
1586	D	78.7	Confident	74.8	Confident	83 Å²	83	82.7 Å²	82.7	44%	0.444	42%	0.419	S	S	.	.	H	α-helix	trans	-66.7	-37.6	178	-60.1	-35	0	0	0	111.4	M1582 T1583 S1590	M1582-D1586 HydrophobicContact CE-CB 4.05Å; M1582-D1586 WeakPolarHBondContact CE-O 3.4Å; M1582-D1586 HydrophobicContact CG-CB 3.85Å; T1583-D1586 PolarHBondContact O-N 3.36Å; T1583-D1586 PolarHBondContact OG1-N 3.19Å; T1583-D1586 PolarHBondContact OG1-OD2 3.49Å; D1586-S1590 WeakPolarHBondContact O-CB 3.46Å; D1586-S1590 PolarHBondContact O-N 3.41Å
1587	I	79.9	Confident	76.3	Confident	50 Å²	50	80.9 Å²	80.9	26%	0.256	40%	0.404	S	S	.	.	H	α-helix	trans	-61.7	-50.9	176	-64.4	170.7	0	0	0	110.5	M1582 T1583 F1584 M1591	M1582-I1587 HydrophobicContact CB-CD1 4.17Å; M1582-I1587 HydrophobicContact CB-CG1 3.79Å; M1582-I1587 HydrophobicContact CE-CG1 4.45Å; M1582-I1587 HydrophobicContact CG-CG1 3.77Å; M1582-I1587 HydrophobicContact SD-CG1 4.13Å; T1583-I1587 WeakPolarHBondContact O-CG1 3.44Å; T1583-I1587 PolarHBondContact O-N 3.04Å; F1584-I1587 PolarHBondContact O-N 3.31Å; I1587-M1591 WeakPolarHBondContact O-CB 3.01Å; I1587-M1591 PolarHBondContact O-N 3.47Å
1588	I	84.2	Confident	77.9	Confident	78 Å²	78	79 Å²	79	40%	0.4	39%	0.39	S	S	.	.	H	α-helix	trans	-63.4	-46.3	179.9	-71.6	-176.7	0	0	0	110.8	F1584 A1585 M1591 Y1592	F1584-I1588 HydrophobicContact CD1-CD1 3.96Å; F1584-I1588 HydrophobicContact CE1-CD1 3.3Å; F1584-I1588 HydrophobicContact CE1-CG1 4.35Å; F1584-I1588 HydrophobicContact CE2-CD1 3.96Å; F1584-I1588 HydrophobicContact CE2-CG1 4.43Å; F1584-I1588 HydrophobicContact CZ-CD1 3.32Å; F1584-I1588 HydrophobicContact CZ-CG1 4.25Å; F1584-I1588 PolarHBondContact O-N 3.28Å; F1584-I1588 VanDerWaalsContact O-N 3.1Å; A1585-I1588 PolarHBondContact O-N 3.03Å; I1588-M1591 PolarHBondContact O-N 3.24Å; I1588-Y1592 WeakPolarHBondContact O-CB 3.48Å; I1588-Y1592 PolarHBondContact O-N 3.19Å
1589	F	83.2	Confident	79.7	Confident	146 Å²	146	72.5 Å²	72.5	64%	0.64	36%	0.36	S	S	*	.	H	α-helix	trans	-62.9	-46.4	-179	-175.8	-98.7	0	0	0	111.2	A1585 T1593	A1585-F1589 VanDerWaalsContact O-CB 3.26Å; A1585-F1589 WeakPolarHBondContact O-CB 3.34Å; A1585-F1589 PolarHBondContact O-N 3.4Å; F1589-T1593 HydrophobicContact CD1-CG2 4.2Å; F1589-T1593 HydrophobicContact CD2-CG2 4.18Å; F1589-T1593 HydrophobicContact CE1-CG2 3.87Å; F1589-T1593 HydrophobicContact CE2-CG2 3.84Å; F1589-T1593 HydrophobicContact CG-CG2 4.35Å; F1589-T1593 HydrophobicContact CZ-CG2 3.68Å; F1589-T1593 WeakPolarHBondContact O-CB 3.46Å; F1589-T1593 VanDerWaalsContact O-CG2 3.27Å; F1589-T1593 WeakPolarHBondContact O-CG2 3.13Å; F1589-T1593 PolarHBondContact O-N 3.37Å; F1589-T1593 PolarHBondContact O-OG1 3.36Å
1590	S	77.8	Confident	81	Confident	35 Å²	35	73.5 Å²	73.5	25%	0.245	36%	0.361	C	S	.	.	H	α-helix	trans	-63	-45.3	176.5	-172	0	0	0	0	111.7	D1586 Y1592 T1593 T1594	D1586-S1590 WeakPolarHBondContact O-CB 3.46Å; D1586-S1590 PolarHBondContact O-N 3.41Å; S1590-Y1592 PolarHBondContact O-N 3.28Å; S1590-T1593 PolarHBondContact O-OG1 3.34Å; S1590-T1594 VanDerWaalsContact O-CB 3.31Å; S1590-T1594 WeakPolarHBondContact O-CB 3.48Å; S1590-T1594 PolarHBondContact O-N 2.79Å; S1590-T1594 PolarHBondContact O-OG1 3.46Å
1591	M	86.6	Confident	82.1	Confident	31 Å²	31	70.4 Å²	70.4	15%	0.153	36%	0.358	C	S	.	.	H	α-helix	trans	-57.7	-50	178.5	176.7	-173.7	92.6	0	0	111.5	A1555 V1556 Q1559 I1587 I1588 A1595	A1555-M1591 HydrophobicContact CB-CE 4.32Å; A1555-M1591 HydrophobicContact CB-CG 3.36Å; A1555-M1591 HydrophobicContact CB-SD 4.17Å; V1556-M1591 HydrophobicContact CB-SD 4.29Å; V1556-M1591 HydrophobicContact CG2-CE 3.87Å; V1556-M1591 HydrophobicContact CG2-SD 3.52Å; V1556-M1591 VanDerWaalsContact CG2-SD 3.52Å; Q1559-M1591 HydrophobicContact CB-CG 4.32Å; Q1559-M1591 HydrophobicContact CG-CB 4.48Å; I1587-M1591 WeakPolarHBondContact O-CB 3.01Å; I1587-M1591 PolarHBondContact O-N 3.47Å; I1588-M1591 PolarHBondContact O-N 3.24Å; M1591-A1595 WeakPolarHBondContact O-CB 3.37Å; M1591-A1595 PolarHBondContact O-N 3.06Å
1592	Y	86.6	Confident	83.2	Confident	99 Å²	99	68.4 Å²	68.4	39%	0.388	35%	0.352	S	S	.	.	H	α-helix	trans	-71	-44.5	-176.4	-170.4	-86.2	0	0	0	112.4	M1551 I1588 S1590 A1595 Y1596	M1551-Y1592 HydrophobicContact CE-CD2 3.96Å; M1551-Y1592 HydrophobicContact CE-CE1 4.35Å; M1551-Y1592 HydrophobicContact CE-CE2 3.18Å; M1551-Y1592 VanDerWaalsContact CE-CZ 3.42Å; M1551-Y1592 WeakPolarHBondContact CE-OH 3.33Å; M1551-Y1592 HydrophobicContact SD-CD2 4.45Å; M1551-Y1592 HydrophobicContact SD-CE2 4.09Å; I1588-Y1592 WeakPolarHBondContact O-CB 3.48Å; I1588-Y1592 PolarHBondContact O-N 3.19Å; S1590-Y1592 PolarHBondContact O-N 3.28Å; Y1592-A1595 PolarHBondContact O-N 3.4Å; Y1592-Y1596 VanDerWaalsContact O-CB 3.3Å; Y1592-Y1596 WeakPolarHBondContact O-CB 3.37Å; Y1592-Y1596 PolarHBondContact O-N 3.43Å
1593	T	84.6	Confident	83.7	Confident	36 Å²	36	69.7 Å²	69.7	22%	0.221	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-44	-179.4	51.2	0	0	0	0	111.8	F1589 S1590 Y1596 F1597	F1589-T1593 HydrophobicContact CD1-CG2 4.2Å; F1589-T1593 HydrophobicContact CD2-CG2 4.18Å; F1589-T1593 HydrophobicContact CE1-CG2 3.87Å; F1589-T1593 HydrophobicContact CE2-CG2 3.84Å; F1589-T1593 HydrophobicContact CG-CG2 4.35Å; F1589-T1593 HydrophobicContact CZ-CG2 3.68Å; F1589-T1593 WeakPolarHBondContact O-CB 3.46Å; F1589-T1593 VanDerWaalsContact O-CG2 3.27Å; F1589-T1593 WeakPolarHBondContact O-CG2 3.13Å; F1589-T1593 PolarHBondContact O-N 3.37Å; F1589-T1593 PolarHBondContact O-OG1 3.36Å; S1590-T1593 PolarHBondContact O-OG1 3.34Å; T1593-Y1596 PolarHBondContact O-N 3.42Å; T1593-F1597 WeakPolarHBondContact O-CD2 3.49Å; T1593-F1597 PolarHBondContact O-N 3.03Å
1594	T	83.8	Confident	83.6	Confident	55 Å²	55	68.9 Å²	68.9	34%	0.337	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-46.9	177.5	-58.7	0	0	0	0	111.7	S1590 Y1596 Q1598	S1590-T1594 VanDerWaalsContact O-CB 3.31Å; S1590-T1594 WeakPolarHBondContact O-CB 3.48Å; S1590-T1594 PolarHBondContact O-N 2.79Å; S1590-T1594 PolarHBondContact O-OG1 3.46Å; T1594-Y1596 PolarHBondContact O-N 2.85Å; T1594-Q1598 HydrophobicContact CG2-CG 4.35Å; T1594-Q1598 VanDerWaalsContact O-CB 3.28Å; T1594-Q1598 WeakPolarHBondContact O-CB 3.46Å; T1594-Q1598 WeakPolarHBondContact O-CG 3.43Å; T1594-Q1598 PolarHBondContact O-N 2.98Å
1595	A	88.8	Confident	83.2	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-40.5	179.3	0	0	0	0	0	113.1	M1551 Y1554 A1555 M1591 Y1592 Q1598 M1599 Y1636	M1551-A1595 HydrophobicContact CG-CB 3.89Å; Y1554-A1595 HydrophobicContact CD1-CB 3.98Å; Y1554-A1595 HydrophobicContact CE1-CB 4.22Å; A1555-A1595 HydrophobicContact CB-CB 3.47Å; A1555-A1595 VanDerWaalsContact CB-CB 3.47Å; M1591-A1595 WeakPolarHBondContact O-CB 3.37Å; M1591-A1595 PolarHBondContact O-N 3.06Å; Y1592-A1595 PolarHBondContact O-N 3.4Å; A1595-Q1598 PolarHBondContact O-N 3.13Å; A1595-M1599 PolarHBondContact O-N 2.9Å; A1595-Y1636 PolarHBondContact O-OH 2.67Å
1596	Y	89.5	Confident	82.7	Confident	96 Å²	96	66.1 Å²	66.1	38%	0.376	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-47.4	177.7	177.5	-96.3	0	0	0	112.3	M1551 Y1592 T1593 T1594 M1599 F1600	M1551-Y1596 HydrophobicContact SD-CD2 4.33Å; Y1592-Y1596 VanDerWaalsContact O-CB 3.3Å; Y1592-Y1596 WeakPolarHBondContact O-CB 3.37Å; Y1592-Y1596 PolarHBondContact O-N 3.43Å; T1593-Y1596 PolarHBondContact O-N 3.42Å; T1594-Y1596 PolarHBondContact O-N 2.85Å; Y1596-M1599 WeakPolarHBondContact O-CB 3.39Å; Y1596-M1599 PolarHBondContact O-N 3.21Å; Y1596-F1600 HydrophobicContact CD2-CE2 4.34Å; Y1596-F1600 HydrophobicContact CE1-CD2 4.13Å; Y1596-F1600 AromaticContact CE1-CE2 3.95Å; Y1596-F1600 HydrophobicContact CE1-CE2 3.95Å; Y1596-F1600 HydrophobicContact CE2-CD2 4.48Å; Y1596-F1600 AromaticContact CE2-CE2 3.69Å; Y1596-F1600 HydrophobicContact CE2-CE2 3.69Å; Y1596-F1600 AromaticContact CZ-CE2 3.46Å; Y1596-F1600 VanDerWaalsContact CZ-CE2 3.46Å; Y1596-F1600 WeakPolarHBondContact O-CD2 3.46Å
1597	F	87.3	Confident	82.2	Confident	106 Å²	106	64.9 Å²	64.9	47%	0.465	34%	0.339	S	S	.	.	H	α-helix	trans	-72.5	-29.4	179.7	-75.7	-61.7	0	0	0	112.9	T1593 M1599 F1600 G1601 D1602	T1593-F1597 WeakPolarHBondContact O-CD2 3.49Å; T1593-F1597 PolarHBondContact O-N 3.03Å; F1597-M1599 VanDerWaalsContact C-N 3.29Å; F1597-M1599 PolarHBondContact O-N 2.92Å; F1597-F1600 PolarHBondContact O-N 3.38Å; F1597-G1601 PolarHBondContact O-N 3.31Å; F1597-D1602 HydrophobicContact CB-CB 4.17Å; F1597-D1602 PolarHBondContact O-N 2.88Å
1598	Q	88.4	Confident	81.8	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.019	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-32.6	171.6	-79.4	174.7	-10	0	0	113	Y1554 T1594 A1595 F1600 G1601 D1602 F1603 L1633	Y1554-Q1598 VanDerWaalsContact CZ-OE1 3.3Å; Y1554-Q1598 PolarHBondContact OH-OE1 3.12Å; T1594-Q1598 HydrophobicContact CG2-CG 4.35Å; T1594-Q1598 VanDerWaalsContact O-CB 3.28Å; T1594-Q1598 WeakPolarHBondContact O-CB 3.46Å; T1594-Q1598 WeakPolarHBondContact O-CG 3.43Å; T1594-Q1598 PolarHBondContact O-N 2.98Å; A1595-Q1598 PolarHBondContact O-N 3.13Å; Q1598-F1600 VanDerWaalsContact C-N 3.33Å; Q1598-F1600 PolarHBondContact O-N 3.44Å; Q1598-G1601 PolarHBondContact O-N 3.24Å; Q1598-D1602 WeakPolarHBondContact CA-O 3.45Å; Q1598-D1602 WeakPolarHBondContact CG-O 3.31Å; Q1598-F1603 PolarHBondContact NE2-O 3.37Å; Q1598-F1603 WeakPolarHBondContact O-CE1 3.33Å; Q1598-L1633 HydrophobicContact CB-CD1 3.87Å; Q1598-L1633 HydrophobicContact CG-CD1 4.11Å
1599	M	87.5	Confident	81.3	Confident	7 Å²	7	63.7 Å²	63.7	3%	0.034	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-37.7	174	-171.4	-178.1	65.8	0	0	112.5	L1547 A1595 Y1596 F1597 Y1636 T1640 F1645	L1547-M1599 HydrophobicContact CD1-SD 3.78Å; L1547-M1599 HydrophobicContact CD2-CE 4.28Å; L1547-M1599 HydrophobicContact CD2-SD 4.17Å; L1547-M1599 HydrophobicContact CG-SD 4.39Å; A1595-M1599 PolarHBondContact O-N 2.9Å; Y1596-M1599 WeakPolarHBondContact O-CB 3.39Å; Y1596-M1599 PolarHBondContact O-N 3.21Å; F1597-M1599 VanDerWaalsContact C-N 3.29Å; F1597-M1599 PolarHBondContact O-N 2.92Å; M1599-Y1636 HydrophobicContact CB-CE1 4.06Å; M1599-T1640 HydrophobicContact CG-CG2 4.14Å; M1599-T1640 HydrophobicContact SD-CG2 4.22Å; M1599-F1645 HydrophobicContact CE-CZ 4.29Å
1600	F	84.4	Confident	80.4	Confident	123 Å²	123	57.8 Å²	57.8	54%	0.539	31%	0.311	S	S	.	.	H	α-helix	trans	-88	-2.8	-178.1	-72.4	-72.2	0	0	0	114.3	Y1596 F1597 Q1598 F1645	Y1596-F1600 HydrophobicContact CD2-CE2 4.34Å; Y1596-F1600 HydrophobicContact CE1-CD2 4.13Å; Y1596-F1600 AromaticContact CE1-CE2 3.95Å; Y1596-F1600 HydrophobicContact CE1-CE2 3.95Å; Y1596-F1600 HydrophobicContact CE2-CD2 4.48Å; Y1596-F1600 AromaticContact CE2-CE2 3.69Å; Y1596-F1600 HydrophobicContact CE2-CE2 3.69Å; Y1596-F1600 AromaticContact CZ-CE2 3.46Å; Y1596-F1600 VanDerWaalsContact CZ-CE2 3.46Å; Y1596-F1600 WeakPolarHBondContact O-CD2 3.46Å; F1597-F1600 PolarHBondContact O-N 3.38Å; Q1598-F1600 VanDerWaalsContact C-N 3.33Å; Q1598-F1600 PolarHBondContact O-N 3.44Å; F1600-F1645 HydrophobicContact CE1-CZ 4.35Å
1601	G	82.6	Confident	79.7	Confident	37 Å²	37	63.2 Å²	63.2	38%	0.381	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.3	0.5	173.5	0	0	0	0	0	116.1	F1597 Q1598 F1603	F1597-G1601 PolarHBondContact O-N 3.31Å; Q1598-G1601 PolarHBondContact O-N 3.24Å; G1601-F1603 VanDerWaalsContact C-N 3.34Å; G1601-F1603 WeakPolarHBondContact O-CD2 3.23Å; G1601-F1603 PolarHBondContact O-N 3.42Å; G1601-F1603 VanDerWaalsContact O-N 3.13Å
1602	D	84.1	Confident	78.5	Confident	95 Å²	95	64.1 Å²	64.1	51%	0.508	34%	0.338	S	S	.	.			trans	-85.2	82.8	169.5	-172.6	-3.2	0	0	0	109.4	F1597 Q1598 S1604	F1597-D1602 HydrophobicContact CB-CB 4.17Å; F1597-D1602 PolarHBondContact O-N 2.88Å; Q1598-D1602 WeakPolarHBondContact CA-O 3.45Å; Q1598-D1602 WeakPolarHBondContact CG-O 3.31Å; D1602-S1604 VanDerWaalsContact C-N 3.33Å; D1602-S1604 PolarHBondContact O-N 3.17Å; D1602-S1604 PolarHBondContact OD1-OG 3.36Å
1603	F	80.4	Confident	76.9	Confident	73 Å²	73	71.3 Å²	71.3	32%	0.32	37%	0.365	S	S	.	.			trans	-73.7	-25.1	-171.8	-57.6	-50.7	0	0	0	113.5	Q1598 G1601 L1605 L1633 V1637	Q1598-F1603 PolarHBondContact NE2-O 3.37Å; Q1598-F1603 WeakPolarHBondContact O-CE1 3.33Å; G1601-F1603 VanDerWaalsContact C-N 3.34Å; G1601-F1603 WeakPolarHBondContact O-CD2 3.23Å; G1601-F1603 PolarHBondContact O-N 3.42Å; G1601-F1603 VanDerWaalsContact O-N 3.13Å; F1603-L1605 HydrophobicContact CB-CD1 4.29Å; F1603-L1605 HydrophobicContact CB-CG 3.91Å; F1603-L1605 PolarHBondContact O-N 3.04Å; F1603-L1633 HydrophobicContact CB-CD2 3.98Å; F1603-L1633 HydrophobicContact CD1-CD1 4.07Å; F1603-L1633 HydrophobicContact CD1-CD2 3.92Å; F1603-L1633 HydrophobicContact CD1-CG 4.32Å; F1603-L1633 HydrophobicContact CG-CD2 4.17Å; F1603-V1637 HydrophobicContact CD1-CG2 4.46Å; F1603-V1637 HydrophobicContact CE1-CG2 3.68Å; F1603-V1637 HydrophobicContact CZ-CG2 4.46Å
1604	S	76	Confident	75.4	Confident	60 Å²	60	73.2 Å²	73.2	42%	0.42	38%	0.376	S	S	.	.			trans	47.3	44.8	-170.7	-68.2	0	0	0	0	112.4	D1602 D1606 A1607 L1608	D1602-S1604 VanDerWaalsContact C-N 3.33Å; D1602-S1604 PolarHBondContact O-N 3.17Å; D1602-S1604 PolarHBondContact OD1-OG 3.36Å; S1604-D1606 PolarHBondContact O-N 3.36Å; S1604-A1607 WeakPolarHBondContact O-CB 3.31Å; S1604-A1607 PolarHBondContact O-N 3.34Å; S1604-L1608 PolarHBondContact O-N 3.19Å
1605	L	72.2	Confident	74.2	Confident	67 Å²	67	71.3 Å²	71.3	35%	0.351	37%	0.365	S	S	.	.	H	α-helix	trans	-54.8	-36.5	-176.7	-82.1	162.7	0	0	0	112.3	F1603 A1607 L1608 Q1609 L1633	F1603-L1605 HydrophobicContact CB-CD1 4.29Å; F1603-L1605 HydrophobicContact CB-CG 3.91Å; F1603-L1605 PolarHBondContact O-N 3.04Å; L1605-A1607 VanDerWaalsContact C-N 3.29Å; L1605-A1607 PolarHBondContact O-N 2.92Å; L1605-L1608 PolarHBondContact O-N 2.65Å; L1605-L1608 VanDerWaalsContact O-N 3.12Å; L1605-Q1609 WeakPolarHBondContact O-CB 3.35Å; L1605-Q1609 WeakPolarHBondContact O-CG 3.29Å; L1605-Q1609 PolarHBondContact O-N 2.94Å; L1605-L1633 HydrophobicContact CD2-CD2 4.5Å
1606	D	71.2	Confident	72.4	Confident	105 Å²	105	77.1 Å²	77.1	56%	0.561	39%	0.392	S	S	*	.	H	α-helix	trans	-61.4	-37.5	178.9	-57.5	-19	0	0	0	112.2	S1604 G1610 E1611	S1604-D1606 PolarHBondContact O-N 3.36Å; D1606-G1610 PolarHBondContact O-N 2.84Å; D1606-E1611 PolarHBondContact O-N 2.8Å
1607	A	68.2	Low	70.6	Confident	58 Å²	58	79 Å²	79	48%	0.479	41%	0.408	S	S	.	.	H	α-helix	trans	-74.2	-32.8	176.3	0	0	0	0	0	112.2	S1604 L1605	S1604-A1607 WeakPolarHBondContact O-CB 3.31Å; S1604-A1607 PolarHBondContact O-N 3.34Å; L1605-A1607 VanDerWaalsContact C-N 3.29Å; L1605-A1607 PolarHBondContact O-N 2.92Å
1608	L	71	Confident	68.8	Low	26 Å²	26	77.2 Å²	77.2	14%	0.136	40%	0.401	C	S	.	.	H	α-helix	trans	-78.5	-38.2	179.1	-71.6	173.2	0	0	0	113.4	S1604 L1605 P1621 V1629 L1633	S1604-L1608 PolarHBondContact O-N 3.19Å; L1605-L1608 PolarHBondContact O-N 2.65Å; L1605-L1608 VanDerWaalsContact O-N 3.12Å; L1608-P1621 WeakPolarHBondContact O-CG 3.4Å; L1608-V1629 HydrophobicContact CD1-CG1 4.36Å; L1608-V1629 HydrophobicContact CD2-CB 4.43Å; L1608-V1629 HydrophobicContact CD2-CG1 3.65Å; L1608-L1633 HydrophobicContact CD1-CD2 4.21Å
1609	Q	73.2	Confident	67.4	Low	77 Å²	77	79.8 Å²	79.8	36%	0.36	41%	0.414	S	S	.	.	H	α-helix	trans	-81.9	-20.8	-179.8	-69.1	178.2	-26.3	0	0	112.2	L1605 P1630	L1605-Q1609 WeakPolarHBondContact O-CB 3.35Å; L1605-Q1609 WeakPolarHBondContact O-CG 3.29Å; L1605-Q1609 PolarHBondContact O-N 2.94Å; Q1609-P1630 HydrophobicContact CG-CG 4.48Å
1610	G	63.4	Low	66.2	Low	22 Å²	22	82.3 Å²	82.3	23%	0.227	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	28.7	-179.8	0	0	0	0	0	113.4	D1606	D1606-G1610 PolarHBondContact O-N 2.84Å
1611	E	64.4	Low	65.5	Low	148 Å²	148	77 Å²	77	69%	0.692	41%	0.409	S	S	*	.			trans	-85.3	-10.2	174.4	-77.3	-166.1	156.9	0	0	113.1	D1606 R1613	D1606-E1611 PolarHBondContact O-N 2.8Å; E1611-R1613 PolarHBondContact O-N 3.04Å; E1611-R1613 VanDerWaalsContact O-N 3.11Å
1612	D	61.6	Low	65.1	Low	50 Å²	50	77.2 Å²	77.2	27%	0.267	40%	0.404	S	S	.	.			trans	-66.3	113.8	177.7	-160.6	-14.8	0	0	0	110.6	T1614 C1615 Q1616	D1612-T1614 PolarHBondContact O-N 2.93Å; D1612-T1614 PolarHBondContact OD1-OG1 2.78Å; D1612-C1615 PolarHBondContact O-N 3.37Å; D1612-Q1616 WeakPolarHBondContact OD2-CG 3.41Å; D1612-Q1616 PolarHBondContact OD2-NE2 3.22Å
1613	R	52.8	Low	64.7	Low	250 Å²	250	81.7 Å²	81.7	94%	0.943	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-14.9	-177.6	-77.6	-178.2	169.6	172.9	-1.8	114	E1611	E1611-R1613 PolarHBondContact O-N 3.04Å; E1611-R1613 VanDerWaalsContact O-N 3.11Å
1614	T	53.1	Low	64.8	Low	76 Å²	76	82 Å²	82	47%	0.466	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-2.8	-176.2	57.3	0	0	0	0	114.2	D1612 Q1616 H1618	D1612-T1614 PolarHBondContact O-N 2.93Å; D1612-T1614 PolarHBondContact OD1-OG1 2.78Å; T1614-Q1616 PolarHBondContact O-N 3.15Å; T1614-Q1616 WeakPolarHBondContact OG1-CG 3.39Å; T1614-H1618 PolarHBondContact O-CE1 3.19Å; T1614-H1618 PolarHBondContact O-ND1 2.66Å
1615	C	57.6	Low	65	Low	15 Å²	15	79.2 Å²	79.2	10%	0.101	41%	0.407	C	S	.	.			trans	26.9	69.3	-164.8	-90.9	0	0	0	0	108	D1612 N1617 H1618 M1619 C1620	D1612-C1615 PolarHBondContact O-N 3.37Å; C1615-N1617 PolarHBondContact O-N 2.71Å; C1615-H1618 WeakPolarHBondContact O-CA 3.42Å; C1615-H1618 PolarHBondContact O-N 3.2Å; C1615-H1618 PolarHBondContact O-ND1 3.35Å; C1615-H1618 VanDerWaalsContact O-ND1 3.17Å; C1615-M1619 WeakPolarHBondContact CB-O 3.37Å; C1615-M1619 PolarHBondContact O-N 3.05Å; C1615-M1619 PolarHBondContact SG-O 3.38Å; C1615-M1619 VanDerWaalsContact SG-O 3.34Å; C1615-C1620 WeakPolarHBondContact CB-SG 3.32Å; C1615-C1620 WeakPolarHBondContact SG-CB 3.47Å; C1615-C1620 CovalentContact SG-SG 2.08Å; C1615-C1620 PolarHBondContact SG-SG 2.72Å
1616	Q	51.4	Low	65.5	Low	124 Å²	124	81.4 Å²	81.4	58%	0.579	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	132.8	-166.5	-72.8	177.6	17.6	0	0	112.5	D1612 T1614 H1618	D1612-Q1616 WeakPolarHBondContact OD2-CG 3.41Å; D1612-Q1616 PolarHBondContact OD2-NE2 3.22Å; T1614-Q1616 PolarHBondContact O-N 3.15Å; T1614-Q1616 WeakPolarHBondContact OG1-CG 3.39Å; Q1616-H1618 PolarHBondContact O-N 2.97Å
1617	N	51.7	Low	66.1	Low	136 Å²	136	83.6 Å²	83.6	73%	0.727	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	3.5	-170.2	-45	-70.7	0	0	0	115.8	C1615 M1619	C1615-N1617 PolarHBondContact O-N 2.71Å; N1617-M1619 HydrophobicContact CB-CG 4.37Å; N1617-M1619 HydrophobicContact CB-SD 4.31Å
1618	H	49.9	Very low	67.1	Low	68 Å²	68	82.9 Å²	82.9	32%	0.315	40%	0.399	S	S	.	.	S	Bend	trans	69.5	60.1	179.3	-54.8	-31.4	0	0	0	114.3	K1570 T1614 C1615 Q1616	K1570-H1618 HydrophobicContact CB-CB 4.12Å; K1570-H1618 VanDerWaalsContact CD-CD2 3.42Å; K1570-H1618 WeakPolarHBondContact CD-CD2 3.28Å; K1570-H1618 HydrophobicContact CG-CB 4.12Å; K1570-H1618 PolarHBondContact NZ-CD2 2.74Å; K1570-H1618 PolarHBondContact NZ-CE1 3.26Å; K1570-H1618 PolarHBondContact NZ-ND1 3.05Å; K1570-H1618 PolarHBondContact NZ-NE2 3.32Å; T1614-H1618 PolarHBondContact O-CE1 3.19Å; T1614-H1618 PolarHBondContact O-ND1 2.66Å; C1615-H1618 WeakPolarHBondContact O-CA 3.42Å; C1615-H1618 PolarHBondContact O-N 3.2Å; C1615-H1618 PolarHBondContact O-ND1 3.35Å; C1615-H1618 VanDerWaalsContact O-ND1 3.17Å; Q1616-H1618 PolarHBondContact O-N 2.97Å
1619	M	58.5	Low	67.9	Low	59 Å²	59	81.8 Å²	81.8	29%	0.291	39%	0.394	S	S	.	.			trans	-126	116.5	-176.9	-55.4	-176.6	75.8	0	0	109.1	Y1563 C1615 N1617	Y1563-M1619 HydrophobicContact CD1-CE 4.27Å; Y1563-M1619 HydrophobicContact CE1-CB 4.13Å; Y1563-M1619 HydrophobicContact CE1-CE 3.64Å; Y1563-M1619 HydrophobicContact CE2-CE 4.2Å; C1615-M1619 WeakPolarHBondContact CB-O 3.37Å; C1615-M1619 PolarHBondContact O-N 3.05Å; C1615-M1619 PolarHBondContact SG-O 3.38Å; C1615-M1619 VanDerWaalsContact SG-O 3.34Å; N1617-M1619 HydrophobicContact CB-CG 4.37Å; N1617-M1619 HydrophobicContact CB-SD 4.31Å
1620	C	63.7	Low	68.5	Low	59 Å²	59	79.7 Å²	79.7	40%	0.399	39%	0.386	S	S	.	.			trans	-124.3	126.3	174.3	-50.6	0	0	0	0	109.6	C1615	C1615-C1620 WeakPolarHBondContact CB-SG 3.32Å; C1615-C1620 WeakPolarHBondContact SG-CB 3.47Å; C1615-C1620 CovalentContact SG-SG 2.08Å; C1615-C1620 PolarHBondContact SG-SG 2.72Å
1621	P	69.5	Low	69.8	Low	11 Å²	11	82.7 Å²	82.7	7%	0.071	40%	0.396	C	S	.	.			trans	-59.7	152.5	-179.3	10.8	-20.5	0	0	0	113	L1608 S1625 R1626	L1608-P1621 WeakPolarHBondContact O-CG 3.4Å; P1621-S1625 WeakPolarHBondContact CB-OG 3.41Å; P1621-R1626 HydrophobicContact CB-CG 4.41Å; P1621-R1626 HydrophobicContact CG-CG 4.25Å
1622	T	74.4	Confident	71	Confident	43 Å²	43	79.5 Å²	79.5	26%	0.264	38%	0.383	S	S	.	.			trans	-56.3	150.8	171.9	69.2	0	0	0	0	111	I1561 P1564 T1624 S1625 R1626	I1561-T1622 PolarHBondContact O-OG1 3.25Å; P1564-T1622 VanDerWaalsContact CD-CG2 3.49Å; P1564-T1622 HydrophobicContact CG-CG2 3.78Å; T1622-T1624 PolarHBondContact O-N 2.97Å; T1622-T1624 VanDerWaalsContact O-N 3.1Å; T1622-S1625 PolarHBondContact N-OG 3.2Å; T1622-S1625 PolarHBondContact O-N 2.72Å; T1622-S1625 PolarHBondContact O-OG 2.85Å; T1622-S1625 WeakPolarHBondContact OG1-CB 3.35Å; T1622-S1625 PolarHBondContact OG1-N 3.13Å; T1622-S1625 PolarHBondContact OG1-OG 3.27Å; T1622-R1626 PolarHBondContact O-N 2.81Å
1623	K	75.5	Confident	72.4	Confident	188 Å²	188	77.6 Å²	77.6	82%	0.817	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-31	179.3	-169	177	179.8	-178.6	0	112.2
1624	T	81.9	Confident	74.1	Confident	79 Å²	79	67.8 Å²	67.8	49%	0.485	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-36.7	177.5	-41.8	0	0	0	0	112.3	T1622 R1626 W1627 L1628	T1622-T1624 PolarHBondContact O-N 2.97Å; T1622-T1624 VanDerWaalsContact O-N 3.1Å; T1624-R1626 VanDerWaalsContact C-N 3.31Å; T1624-R1626 PolarHBondContact O-N 3.29Å; T1624-W1627 HydrophobicContact CG2-CZ2 4.46Å; T1624-W1627 VanDerWaalsContact O-CD1 3.27Å; T1624-W1627 PolarHBondContact O-NE1 2.66Å; T1624-L1628 WeakPolarHBondContact O-CB 3.02Å; T1624-L1628 PolarHBondContact O-N 2.67Å
1625	S	80.5	Confident	75.9	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.014	36%	0.356	C	S	.	.	H	α-helix	trans	-69.4	-27.4	-177.5	70.2	0	0	0	0	113.4	P1621 T1622 W1627 L1628 V1629	P1621-S1625 WeakPolarHBondContact CB-OG 3.41Å; T1622-S1625 PolarHBondContact N-OG 3.2Å; T1622-S1625 PolarHBondContact O-N 2.72Å; T1622-S1625 PolarHBondContact O-OG 2.85Å; T1622-S1625 WeakPolarHBondContact OG1-CB 3.35Å; T1622-S1625 PolarHBondContact OG1-N 3.13Å; T1622-S1625 PolarHBondContact OG1-OG 3.27Å; S1625-W1627 PolarHBondContact O-N 3.41Å; S1625-L1628 PolarHBondContact O-N 3.2Å; S1625-V1629 WeakPolarHBondContact O-CB 3.45Å; S1625-V1629 WeakPolarHBondContact O-CG2 3.12Å; S1625-V1629 PolarHBondContact O-N 2.98Å
1626	R	81.4	Confident	77.5	Confident	114 Å²	114	70.5 Å²	70.5	43%	0.43	35%	0.353	S	S	.	.	H	α-helix	trans	-58.8	-27.2	-177.8	-67.6	-177.3	-175.4	-168.8	-6.2	115.1	P1621 T1622 T1624	P1621-R1626 HydrophobicContact CB-CG 4.41Å; P1621-R1626 HydrophobicContact CG-CG 4.25Å; T1622-R1626 PolarHBondContact O-N 2.81Å; T1624-R1626 VanDerWaalsContact C-N 3.31Å; T1624-R1626 PolarHBondContact O-N 3.29Å
1627	W	85.4	Confident	79.3	Confident	151 Å²	151	66 Å²	66	57%	0.572	33%	0.333	S	S	*	.	H	α-helix	trans	-111.1	-32.1	177.4	68.5	-89.2	0	0	0	112.5	T1624 S1625 I1631	T1624-W1627 HydrophobicContact CG2-CZ2 4.46Å; T1624-W1627 VanDerWaalsContact O-CD1 3.27Å; T1624-W1627 PolarHBondContact O-NE1 2.66Å; S1625-W1627 PolarHBondContact O-N 3.41Å; W1627-I1631 HydrophobicContact CE3-CD1 3.8Å; W1627-I1631 HydrophobicContact CZ3-CD1 4.07Å; W1627-I1631 WeakPolarHBondContact O-CD1 3.37Å; W1627-I1631 WeakPolarHBondContact O-CG1 3.48Å
1628	L	88.8	Confident	81	Confident	43 Å²	43	64.3 Å²	64.3	23%	0.225	32%	0.324	C	S	.	.	H	α-helix	trans	-77.3	-41.2	-175.7	-176.8	61.5	0	0	0	113	I1561 T1624 S1625 I1631 M1632	I1561-L1628 HydrophobicContact CD1-CD2 3.96Å; I1561-L1628 HydrophobicContact CG2-CD2 4.27Å; T1624-L1628 WeakPolarHBondContact O-CB 3.02Å; T1624-L1628 PolarHBondContact O-N 2.67Å; S1625-L1628 PolarHBondContact O-N 3.2Å; L1628-I1631 PolarHBondContact O-N 3.22Å; L1628-M1632 WeakPolarHBondContact O-CG 3.45Å; L1628-M1632 PolarHBondContact O-N 3.03Å
1629	V	86.4	Confident	82.9	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.018	33%	0.327	C	S	.	.	H	α-helix	trans	-67.2	-41.1	-177.7	-178.8	0	0	0	0	112	A1558 I1561 L1608 S1625 I1631 M1632 L1633	A1558-V1629 HydrophobicContact CB-CG1 4.19Å; I1561-V1629 HydrophobicContact CB-CG2 4.24Å; I1561-V1629 HydrophobicContact CG2-CG2 3.82Å; L1608-V1629 HydrophobicContact CD1-CG1 4.36Å; L1608-V1629 HydrophobicContact CD2-CB 4.43Å; L1608-V1629 HydrophobicContact CD2-CG1 3.65Å; S1625-V1629 WeakPolarHBondContact O-CB 3.45Å; S1625-V1629 WeakPolarHBondContact O-CG2 3.12Å; S1625-V1629 PolarHBondContact O-N 2.98Å; V1629-I1631 VanDerWaalsContact C-N 3.29Å; V1629-I1631 PolarHBondContact O-N 3.2Å; V1629-M1632 PolarHBondContact O-N 2.98Å; V1629-L1633 WeakPolarHBondContact O-CB 3.19Å; V1629-L1633 PolarHBondContact O-N 2.72Å
1630	P	87.3	Confident	84.3	Confident	32 Å²	32	61.7 Å²	61.7	21%	0.208	31%	0.313	C	S	.	.	H	α-helix	trans	-58.5	-34.3	171.3	-28.1	36.6	0	0	0	114.6	Q1609 G1634	Q1609-P1630 HydrophobicContact CG-CG 4.48Å; P1630-G1634 PolarHBondContact O-N 2.96Å
1631	I	90	Very high	85.3	Confident	85 Å²	85	62.2 Å²	62.2	44%	0.436	31%	0.312	S	S	.	.	H	α-helix	trans	-69	-46.8	175	-66	170.8	0	0	0	110.4	W1627 L1628 V1629 L1633 G1634 F1635	W1627-I1631 HydrophobicContact CE3-CD1 3.8Å; W1627-I1631 HydrophobicContact CZ3-CD1 4.07Å; W1627-I1631 WeakPolarHBondContact O-CD1 3.37Å; W1627-I1631 WeakPolarHBondContact O-CG1 3.48Å; L1628-I1631 PolarHBondContact O-N 3.22Å; V1629-I1631 VanDerWaalsContact C-N 3.29Å; V1629-I1631 PolarHBondContact O-N 3.2Å; I1631-L1633 VanDerWaalsContact C-N 3.28Å; I1631-L1633 PolarHBondContact O-N 3.2Å; I1631-G1634 PolarHBondContact O-N 2.63Å; I1631-G1634 VanDerWaalsContact O-N 3.12Å; I1631-F1635 HydrophobicContact CG2-CD2 4.07Å; I1631-F1635 HydrophobicContact CG2-CE2 3.94Å; I1631-F1635 WeakPolarHBondContact O-CD2 3.42Å; I1631-F1635 PolarHBondContact O-N 3.28Å; I1631-F1635 VanDerWaalsContact O-N 3.13Å
1632	M	90	Very high	86.1	Confident	82 Å²	82	66.7 Å²	66.7	40%	0.404	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-39.9	175.4	-72.9	-67.2	-162.1	0	0	111.8	Y1554 L1628 V1629 G1634 F1635 Y1636	Y1554-M1632 HydrophobicContact CE2-CB 4.24Å; L1628-M1632 WeakPolarHBondContact O-CG 3.45Å; L1628-M1632 PolarHBondContact O-N 3.03Å; V1629-M1632 PolarHBondContact O-N 2.98Å; M1632-G1634 VanDerWaalsContact C-N 3.35Å; M1632-F1635 PolarHBondContact O-N 3.18Å; M1632-Y1636 WeakPolarHBondContact O-CB 3.38Å; M1632-Y1636 PolarHBondContact O-N 3.27Å
1633	L	90.3	Very high	86.6	Confident	9 Å²	9	69 Å²	69	5%	0.047	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-42.9	174.2	175.9	65.1	0	0	0	111.3	Y1554 Q1598 F1603 L1605 L1608 V1629 I1631 F1635 Y1636 V1637	Y1554-L1633 WeakPolarHBondContact OH-CD1 3.36Å; Q1598-L1633 HydrophobicContact CB-CD1 3.87Å; Q1598-L1633 HydrophobicContact CG-CD1 4.11Å; F1603-L1633 HydrophobicContact CB-CD2 3.98Å; F1603-L1633 HydrophobicContact CD1-CD1 4.07Å; F1603-L1633 HydrophobicContact CD1-CD2 3.92Å; F1603-L1633 HydrophobicContact CD1-CG 4.32Å; F1603-L1633 HydrophobicContact CG-CD2 4.17Å; L1605-L1633 HydrophobicContact CD2-CD2 4.5Å; L1608-L1633 HydrophobicContact CD1-CD2 4.21Å; V1629-L1633 WeakPolarHBondContact O-CB 3.19Å; V1629-L1633 PolarHBondContact O-N 2.72Å; I1631-L1633 VanDerWaalsContact C-N 3.28Å; I1631-L1633 PolarHBondContact O-N 3.2Å; L1633-F1635 PolarHBondContact O-N 3.42Å; L1633-Y1636 HydrophobicContact CD1-CD1 4.38Å; L1633-Y1636 PolarHBondContact O-N 3.23Å; L1633-V1637 HydrophobicContact CD1-CG2 3.9Å; L1633-V1637 HydrophobicContact CG-CG2 4.34Å; L1633-V1637 WeakPolarHBondContact O-CB 3.5Å; L1633-V1637 VanDerWaalsContact O-CG2 3.26Å; L1633-V1637 WeakPolarHBondContact O-CG2 3.4Å; L1633-V1637 PolarHBondContact O-N 2.86Å
1634	G	88.1	Confident	87.2	Confident	45 Å²	45	60.9 Å²	60.9	46%	0.464	31%	0.31	S	S	.	.	H	α-helix	trans	-58.3	-45.7	175.2	0	0	0	0	0	113	P1630 I1631 M1632 L1638	P1630-G1634 PolarHBondContact O-N 2.96Å; I1631-G1634 PolarHBondContact O-N 2.63Å; I1631-G1634 VanDerWaalsContact O-N 3.12Å; M1632-G1634 VanDerWaalsContact C-N 3.35Å; G1634-L1638 WeakPolarHBondContact O-CB 3.28Å; G1634-L1638 PolarHBondContact O-N 2.92Å; G1634-L1638 VanDerWaalsContact O-N 3.07Å
1635	F	90.8	Very high	87.4	Confident	138 Å²	138	60.3 Å²	60.3	61%	0.605	30%	0.301	S	S	*	.	H	α-helix	trans	-64.8	-42.3	174.4	-81.5	-72.2	0	0	0	112.7	I1631 M1632 L1633 L1638 L1639	I1631-F1635 HydrophobicContact CG2-CD2 4.07Å; I1631-F1635 HydrophobicContact CG2-CE2 3.94Å; I1631-F1635 WeakPolarHBondContact O-CD2 3.42Å; I1631-F1635 PolarHBondContact O-N 3.28Å; I1631-F1635 VanDerWaalsContact O-N 3.13Å; M1632-F1635 PolarHBondContact O-N 3.18Å; L1633-F1635 PolarHBondContact O-N 3.42Å; F1635-L1638 PolarHBondContact O-N 3.27Å; F1635-L1639 WeakPolarHBondContact O-CB 2.88Å; F1635-L1639 PolarHBondContact O-N 2.99Å
1636	Y	92.2	Very high	87.8	Confident	10 Å²	10	64.8 Å²	64.8	4%	0.039	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-49.7	178.1	173.1	-114.2	0	0	0	111.5	I1550 Y1554 A1595 M1599 M1632 L1633 L1638 L1639 T1640	I1550-Y1636 HydrophobicContact CG2-CD2 4.36Å; I1550-Y1636 HydrophobicContact CG2-CE2 4.18Å; Y1554-Y1636 AromaticContact CD1-CD1 3.66Å; Y1554-Y1636 HydrophobicContact CD1-CD1 3.66Å; Y1554-Y1636 AromaticContact CD1-CD2 3.92Å; Y1554-Y1636 HydrophobicContact CD1-CD2 3.92Å; Y1554-Y1636 AromaticContact CD1-CE1 3.79Å; Y1554-Y1636 HydrophobicContact CD1-CE1 3.79Å; Y1554-Y1636 HydrophobicContact CD1-CE2 4.04Å; Y1554-Y1636 AromaticContact CD1-CG 3.73Å; Y1554-Y1636 HydrophobicContact CD1-CG 3.73Å; Y1554-Y1636 AromaticContact CD1-CZ 3.98Å; Y1554-Y1636 HydrophobicContact CD2-CD1 4.42Å; Y1554-Y1636 HydrophobicContact CD2-CD2 4.29Å; Y1554-Y1636 AromaticContact CD2-CG 3.89Å; Y1554-Y1636 HydrophobicContact CD2-CG 3.89Å; Y1554-Y1636 AromaticContact CE1-CD1 3.69Å; Y1554-Y1636 HydrophobicContact CE1-CD1 3.69Å; Y1554-Y1636 AromaticContact CE1-CE1 3.94Å; Y1554-Y1636 HydrophobicContact CE1-CE1 3.94Å; Y1554-Y1636 HydrophobicContact CE1-CG 4.11Å; Y1554-Y1636 HydrophobicContact CE2-CD1 4.45Å; Y1554-Y1636 HydrophobicContact CE2-CG 4.27Å; Y1554-Y1636 HydrophobicContact CG-CD1 4.05Å; Y1554-Y1636 AromaticContact CG-CD2 3.67Å; Y1554-Y1636 HydrophobicContact CG-CD2 3.67Å; Y1554-Y1636 HydrophobicContact CG-CE1 4.49Å; Y1554-Y1636 HydrophobicContact CG-CE2 4.16Å; Y1554-Y1636 AromaticContact CG-CG 3.61Å; Y1554-Y1636 HydrophobicContact CG-CG 3.61Å; A1595-Y1636 PolarHBondContact O-OH 2.67Å; M1599-Y1636 HydrophobicContact CB-CE1 4.06Å; M1632-Y1636 WeakPolarHBondContact O-CB 3.38Å; M1632-Y1636 PolarHBondContact O-N 3.27Å; L1633-Y1636 HydrophobicContact CD1-CD1 4.38Å; L1633-Y1636 PolarHBondContact O-N 3.23Å; Y1636-L1638 PolarHBondContact O-N 3.12Å; Y1636-L1639 PolarHBondContact O-N 3.46Å; Y1636-T1640 HydrophobicContact CD2-CG2 3.96Å; Y1636-T1640 HydrophobicContact CE2-CG2 3.54Å; Y1636-T1640 WeakPolarHBondContact O-CG2 3.23Å; Y1636-T1640 PolarHBondContact O-N 3.4Å; Y1636-T1640 PolarHBondContact O-OG1 3.17Å; Y1636-T1640 VanDerWaalsContact O-OG1 3.13Å
1637	V	89.4	Confident	88.2	Confident	28 Å²	28	63.1 Å²	63.1	17%	0.17	32%	0.323	C	S	.	.	H	α-helix	trans	-64.1	-39.9	179.5	173.9	0	0	0	0	111.6	F1603 L1633 T1640 N1641	F1603-V1637 HydrophobicContact CD1-CG2 4.46Å; F1603-V1637 HydrophobicContact CE1-CG2 3.68Å; F1603-V1637 HydrophobicContact CZ-CG2 4.46Å; L1633-V1637 HydrophobicContact CD1-CG2 3.9Å; L1633-V1637 HydrophobicContact CG-CG2 4.34Å; L1633-V1637 WeakPolarHBondContact O-CB 3.5Å; L1633-V1637 VanDerWaalsContact O-CG2 3.26Å; L1633-V1637 WeakPolarHBondContact O-CG2 3.4Å; L1633-V1637 PolarHBondContact O-N 2.86Å; V1637-T1640 PolarHBondContact O-OG1 3.24Å; V1637-N1641 WeakPolarHBondContact CG1-ND2 3.28Å; V1637-N1641 WeakPolarHBondContact O-CB 3.38Å; V1637-N1641 PolarHBondContact O-N 2.68Å
1638	L	87.6	Confident	88.5	Confident	101 Å²	101	56.9 Å²	56.9	53%	0.529	30%	0.301	S	S	.	.	H	α-helix	trans	-59.3	-49.1	174.2	-175.9	104.2	0	0	0	110.9	G1634 F1635 Y1636 I1642	G1634-L1638 WeakPolarHBondContact O-CB 3.28Å; G1634-L1638 PolarHBondContact O-N 2.92Å; G1634-L1638 VanDerWaalsContact O-N 3.07Å; F1635-L1638 PolarHBondContact O-N 3.27Å; Y1636-L1638 PolarHBondContact O-N 3.12Å; L1638-I1642 HydrophobicContact CD1-CD1 3.64Å; L1638-I1642 HydrophobicContact CG-CD1 3.98Å; L1638-I1642 WeakPolarHBondContact O-CB 3.47Å; L1638-I1642 PolarHBondContact O-N 3.33Å
1639	L	89.3	Confident	88.6	Confident	72 Å²	72	60.1 Å²	60.1	38%	0.377	32%	0.318	S	S	.	.	I	π-helix	trans	-67.6	-41.8	-176.8	-172.4	135	0	0	0	112.1	I1550 F1635 Y1636 L1643 M1644	I1550-L1639 HydrophobicContact CD1-CD2 3.87Å; I1550-L1639 HydrophobicContact CG1-CD2 4.35Å; I1550-L1639 HydrophobicContact CG2-CD2 3.56Å; F1635-L1639 WeakPolarHBondContact O-CB 2.88Å; F1635-L1639 PolarHBondContact O-N 2.99Å; Y1636-L1639 PolarHBondContact O-N 3.46Å; L1639-L1643 VanDerWaalsContact O-CB 3.24Å; L1639-L1643 WeakPolarHBondContact O-CB 3.09Å; L1639-L1643 PolarHBondContact O-N 2.95Å; L1639-M1644 PolarHBondContact O-N 3.27Å
1640	T	88.8	Confident	88.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.006	34%	0.34	C	S	.	.	I	π-helix	trans	-72	-43.4	177.9	56.3	0	0	0	0	112.3	L1547 M1599 Y1636 V1637 M1644 F1645	L1547-T1640 HydrophobicContact CD1-CG2 4.45Å; M1599-T1640 HydrophobicContact CG-CG2 4.14Å; M1599-T1640 HydrophobicContact SD-CG2 4.22Å; Y1636-T1640 HydrophobicContact CD2-CG2 3.96Å; Y1636-T1640 HydrophobicContact CE2-CG2 3.54Å; Y1636-T1640 WeakPolarHBondContact O-CG2 3.23Å; Y1636-T1640 PolarHBondContact O-N 3.4Å; Y1636-T1640 PolarHBondContact O-OG1 3.17Å; Y1636-T1640 VanDerWaalsContact O-OG1 3.13Å; V1637-T1640 PolarHBondContact O-OG1 3.24Å; T1640-M1644 WeakPolarHBondContact O-CB 3.23Å; T1640-M1644 PolarHBondContact O-N 3.49Å; T1640-F1645 PolarHBondContact O-N 3.5Å
1641	N	84.8	Confident	89	Confident	69 Å²	69	64.8 Å²	64.8	37%	0.369	35%	0.348	S	S	.	.	I	π-helix	trans	-80.6	-37.7	-170.9	-68.7	-5.6	0	0	0	113.5	V1637	V1637-N1641 WeakPolarHBondContact CG1-ND2 3.28Å; V1637-N1641 WeakPolarHBondContact O-CB 3.38Å; V1637-N1641 PolarHBondContact O-N 2.68Å
1642	I	85.1	Confident	89.1	Confident	105 Å²	105	63.6 Å²	63.6	54%	0.538	34%	0.339	S	S	.	.	I	π-helix	trans	-89.2	-40.5	-175.9	-57.7	-178.1	0	0	0	111.5	L1638 N1646	L1638-I1642 HydrophobicContact CD1-CD1 3.64Å; L1638-I1642 HydrophobicContact CG-CD1 3.98Å; L1638-I1642 WeakPolarHBondContact O-CB 3.47Å; L1638-I1642 PolarHBondContact O-N 3.33Å; I1642-N1646 PolarHBondContact O-ND2 2.83Å
1643	L	85.6	Confident	89.2	Confident	92 Å²	92	62.3 Å²	62.3	48%	0.482	34%	0.339	S	S	.	.	I	π-helix	trans	-89.6	-55.5	-174.4	-168.5	77.4	0	0	0	111.3	L1639 L1647	L1639-L1643 VanDerWaalsContact O-CB 3.24Å; L1639-L1643 WeakPolarHBondContact O-CB 3.09Å; L1639-L1643 PolarHBondContact O-N 2.95Å; L1643-L1647 HydrophobicContact CG-CD1 4.34Å; L1643-L1647 WeakPolarHBondContact O-CG 3.16Å; L1643-L1647 PolarHBondContact O-N 2.99Å
1644	M	87.2	Confident	89.2	Confident	18 Å²	18	68.8 Å²	68.8	9%	0.089	37%	0.366	C	S	.	.	I	π-helix	trans	-72.9	-48.5	-166.3	-66.8	-69.6	119.3	0	0	113	F1543 I1546 I1550 L1639 T1640 N1646 L1647 L1648	F1543-M1644 HydrophobicContact CE2-CB 4Å; F1543-M1644 WeakPolarHBondContact CE2-O 3.41Å; F1543-M1644 HydrophobicContact CE2-SD 4.25Å; F1543-M1644 HydrophobicContact CZ-CB 3.84Å; F1543-M1644 WeakPolarHBondContact CZ-O 3.18Å; I1546-M1644 HydrophobicContact CG2-SD 4.03Å; I1550-M1644 HydrophobicContact CD1-CE 4.2Å; I1550-M1644 HydrophobicContact CD1-CG 4.17Å; I1550-M1644 HydrophobicContact CD1-SD 3.85Å; L1639-M1644 PolarHBondContact O-N 3.27Å; T1640-M1644 WeakPolarHBondContact O-CB 3.23Å; T1640-M1644 PolarHBondContact O-N 3.49Å; M1644-N1646 VanDerWaalsContact C-N 3.33Å; M1644-N1646 PolarHBondContact O-N 3.13Å; M1644-L1647 HydrophobicContact CE-CD1 4.14Å; M1644-L1647 PolarHBondContact O-N 3.11Å; M1644-L1648 PolarHBondContact O-N 3.37Å; M1644-L1648 VanDerWaalsContact O-N 3.09Å
1645	F	86.8	Confident	89.2	Confident	67 Å²	67	66.7 Å²	66.7	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-64.6	-35.4	-179.1	-74.7	-57.7	0	0	0	113.4	M1599 F1600 T1640 L1648 I1649	M1599-F1645 HydrophobicContact CE-CZ 4.29Å; F1600-F1645 HydrophobicContact CE1-CZ 4.35Å; T1640-F1645 PolarHBondContact O-N 3.5Å; F1645-L1648 PolarHBondContact O-N 3.24Å; F1645-I1649 WeakPolarHBondContact O-CG1 3.24Å; F1645-I1649 PolarHBondContact O-N 3.1Å; F1645-I1649 VanDerWaalsContact O-N 3.07Å
1646	N	88.6	Confident	89.1	Confident	96 Å²	96	64.3 Å²	64.3	51%	0.513	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-38	176.4	-74.3	-27.4	0	0	0	112.2	I1642 M1644 I1649 A1650	I1642-N1646 PolarHBondContact O-ND2 2.83Å; M1644-N1646 VanDerWaalsContact C-N 3.33Å; M1644-N1646 PolarHBondContact O-N 3.13Å; N1646-I1649 PolarHBondContact O-N 2.8Å; N1646-A1650 PolarHBondContact O-N 3.26Å; N1646-A1650 VanDerWaalsContact O-N 3.08Å
1647	L	90.2	Very high	88.9	Confident	78 Å²	78	69.5 Å²	69.5	41%	0.408	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-40.9	173.2	-72.4	173.1	0	0	0	112.1	L1643 M1644 I1649 A1650 M1651	L1643-L1647 HydrophobicContact CG-CD1 4.34Å; L1643-L1647 WeakPolarHBondContact O-CG 3.16Å; L1643-L1647 PolarHBondContact O-N 2.99Å; M1644-L1647 HydrophobicContact CE-CD1 4.14Å; M1644-L1647 PolarHBondContact O-N 3.11Å; L1647-I1649 VanDerWaalsContact C-N 3.35Å; L1647-I1649 PolarHBondContact O-N 3.41Å; L1647-A1650 PolarHBondContact O-N 3.17Å; L1647-M1651 WeakPolarHBondContact O-CG 3.39Å; L1647-M1651 PolarHBondContact O-N 2.65Å
1648	L	90.4	Very high	88.6	Confident	21 Å²	21	74.2 Å²	74.2	11%	0.11	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-43.1	177.2	-176.4	64.4	0	0	0	111.8	L1540 F1543 M1644 F1645 M1651 F1652	L1540-L1648 HydrophobicContact CD1-CD1 4.29Å; F1543-L1648 HydrophobicContact CB-CD1 4.05Å; F1543-L1648 HydrophobicContact CD1-CB 4.44Å; F1543-L1648 HydrophobicContact CD1-CD1 3.79Å; F1543-L1648 HydrophobicContact CD1-CD2 4.06Å; F1543-L1648 HydrophobicContact CD1-CG 4.31Å; F1543-L1648 HydrophobicContact CD2-CB 4.14Å; F1543-L1648 HydrophobicContact CD2-CD1 4.2Å; F1543-L1648 HydrophobicContact CE1-CB 4.15Å; F1543-L1648 HydrophobicContact CE1-CD1 4.27Å; F1543-L1648 HydrophobicContact CE1-CD2 3.8Å; F1543-L1648 HydrophobicContact CE1-CG 4.29Å; F1543-L1648 HydrophobicContact CE2-CB 3.85Å; F1543-L1648 HydrophobicContact CG-CB 4.42Å; F1543-L1648 HydrophobicContact CG-CD1 3.74Å; F1543-L1648 HydrophobicContact CZ-CB 3.83Å; F1543-L1648 HydrophobicContact CZ-CD2 4.27Å; F1543-L1648 HydrophobicContact CZ-CG 4.47Å; M1644-L1648 PolarHBondContact O-N 3.37Å; M1644-L1648 VanDerWaalsContact O-N 3.09Å; F1645-L1648 PolarHBondContact O-N 3.24Å; L1648-M1651 PolarHBondContact O-N 3.27Å; L1648-F1652 HydrophobicContact CD1-CD1 4.48Å; L1648-F1652 HydrophobicContact CD1-CD2 4.38Å; L1648-F1652 HydrophobicContact CD1-CE1 3.95Å; L1648-F1652 HydrophobicContact CD1-CE2 3.84Å; L1648-F1652 HydrophobicContact CD1-CZ 3.62Å; L1648-F1652 HydrophobicContact CD2-CE2 4.14Å; L1648-F1652 HydrophobicContact CG-CD2 4.17Å; L1648-F1652 HydrophobicContact CG-CE2 3.81Å; L1648-F1652 HydrophobicContact CG-CZ 4.13Å; L1648-F1652 WeakPolarHBondContact O-CG 3.44Å; L1648-F1652 PolarHBondContact O-N 2.84Å
1649	I	91	Very high	88.3	Confident	111 Å²	111	69.7 Å²	69.7	57%	0.569	35%	0.353	S	S	*	.	H	α-helix	trans	-62	-44.7	177	-66.1	165.2	0	0	0	110.6	F1645 N1646 L1647 F1652 S1653	F1645-I1649 WeakPolarHBondContact O-CG1 3.24Å; F1645-I1649 PolarHBondContact O-N 3.1Å; F1645-I1649 VanDerWaalsContact O-N 3.07Å; N1646-I1649 PolarHBondContact O-N 2.8Å; L1647-I1649 VanDerWaalsContact C-N 3.35Å; L1647-I1649 PolarHBondContact O-N 3.41Å; I1649-F1652 PolarHBondContact O-N 3.07Å; I1649-S1653 PolarHBondContact O-N 3.25Å
1650	A	91.5	Very high	88.1	Confident	58 Å²	58	70.7 Å²	70.7	48%	0.479	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-43	178.3	0	0	0	0	0	112.5	N1646 L1647 S1653 K1654	N1646-A1650 PolarHBondContact O-N 3.26Å; N1646-A1650 VanDerWaalsContact O-N 3.08Å; L1647-A1650 PolarHBondContact O-N 3.17Å; A1650-S1653 PolarHBondContact O-N 2.78Å; A1650-K1654 PolarHBondContact O-N 3.04Å
1651	M	90.8	Very high	87.8	Confident	75 Å²	75	75.3 Å²	75.3	37%	0.369	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-43.3	176.1	-69.7	-179.2	-172.4	0	0	111.6	D1539 L1647 L1648 T1655	D1539-M1651 HydrophobicContact CB-CB 4.12Å; L1647-M1651 WeakPolarHBondContact O-CG 3.39Å; L1647-M1651 PolarHBondContact O-N 2.65Å; L1648-M1651 PolarHBondContact O-N 3.27Å; M1651-T1655 PolarHBondContact O-N 3.22Å; M1651-T1655 PolarHBondContact O-OG1 3.39Å
1652	F	92.5	Very high	87.6	Confident	59 Å²	59	73.1 Å²	73.1	26%	0.259	38%	0.38	S	S	.	.	H	α-helix	trans	-66.7	-41.3	177	-72	-17.7	0	0	0	113.3	M1535 D1539 L1540 L1648 I1649 K1654 T1655 Y1656	M1535-F1652 HydrophobicContact CB-CD1 3.96Å; M1535-F1652 HydrophobicContact CB-CE1 3.92Å; M1535-F1652 WeakPolarHBondContact CE-O 3.36Å; M1535-F1652 HydrophobicContact CG-CD1 4.09Å; D1539-F1652 HydrophobicContact CB-CD1 3.92Å; D1539-F1652 HydrophobicContact CB-CE1 3.84Å; L1540-F1652 HydrophobicContact CB-CE1 4.23Å; L1540-F1652 HydrophobicContact CB-CZ 4.11Å; L1540-F1652 HydrophobicContact CD1-CZ 4.12Å; L1648-F1652 HydrophobicContact CD1-CD1 4.48Å; L1648-F1652 HydrophobicContact CD1-CD2 4.38Å; L1648-F1652 HydrophobicContact CD1-CE1 3.95Å; L1648-F1652 HydrophobicContact CD1-CE2 3.84Å; L1648-F1652 HydrophobicContact CD1-CZ 3.62Å; L1648-F1652 HydrophobicContact CD2-CE2 4.14Å; L1648-F1652 HydrophobicContact CG-CD2 4.17Å; L1648-F1652 HydrophobicContact CG-CE2 3.81Å; L1648-F1652 HydrophobicContact CG-CZ 4.13Å; L1648-F1652 WeakPolarHBondContact O-CG 3.44Å; L1648-F1652 PolarHBondContact O-N 2.84Å; I1649-F1652 PolarHBondContact O-N 3.07Å; F1652-K1654 VanDerWaalsContact C-N 3.31Å; F1652-K1654 PolarHBondContact O-N 3.16Å; F1652-T1655 PolarHBondContact O-N 3.3Å; F1652-Y1656 WeakPolarHBondContact O-CB 3.16Å; F1652-Y1656 PolarHBondContact O-N 2.9Å
1653	S	91.5	Very high	87.4	Confident	56 Å²	56	69.4 Å²	69.4	39%	0.392	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-42.5	178.1	-158.7	0	0	0	0	111.7	I1649 A1650 Y1656 E1657	I1649-S1653 PolarHBondContact O-N 3.25Å; A1650-S1653 PolarHBondContact O-N 2.78Å; S1653-Y1656 WeakPolarHBondContact O-CB 3.26Å; S1653-Y1656 PolarHBondContact O-N 3.46Å; S1653-E1657 WeakPolarHBondContact O-CG 3.15Å; S1653-E1657 PolarHBondContact O-N 3.01Å; S1653-E1657 PolarHBondContact OG-OE1 3.43Å
1654	K	91.9	Very high	87.3	Confident	145 Å²	145	69.1 Å²	69.1	63%	0.63	37%	0.365	S	S	*	.	H	α-helix	trans	-62	-48	177.9	-176.4	176.2	-178.8	172.3	0	112.5	A1650 F1652 Y1656 E1658	A1650-K1654 PolarHBondContact O-N 3.04Å; F1652-K1654 VanDerWaalsContact C-N 3.31Å; F1652-K1654 PolarHBondContact O-N 3.16Å; K1654-Y1656 VanDerWaalsContact C-N 3.28Å; K1654-Y1656 PolarHBondContact O-N 3.06Å; K1654-E1658 PolarHBondContact O-N 3.15Å
1655	T	88	Confident	87.1	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.006	38%	0.382	C	S	.	.	H	α-helix	trans	-66.5	-31.9	177.6	-62.5	0	0	0	0	111.7	K1534 M1535 D1539 M1651 F1652 I1659	K1534-T1655 HydrophobicContact CB-CG2 4.3Å; M1535-T1655 HydrophobicContact CG-CG2 3.72Å; D1539-T1655 VanDerWaalsContact OD2-CB 3.31Å; D1539-T1655 WeakPolarHBondContact OD2-CB 3.38Å; D1539-T1655 PolarHBondContact OD2-OG1 3.2Å; M1651-T1655 PolarHBondContact O-N 3.22Å; M1651-T1655 PolarHBondContact O-OG1 3.39Å; F1652-T1655 PolarHBondContact O-N 3.3Å; T1655-I1659 HydrophobicContact CG2-CD1 3.71Å; T1655-I1659 VanDerWaalsContact O-CD1 3.29Å; T1655-I1659 WeakPolarHBondContact O-CD1 3.42Å; T1655-I1659 VanDerWaalsContact O-CG1 3.31Å; T1655-I1659 WeakPolarHBondContact O-CG1 3.44Å; T1655-I1659 PolarHBondContact O-N 2.96Å
1656	Y	88	Confident	86.9	Confident	87 Å²	87	74.1 Å²	74.1	34%	0.341	38%	0.382	S	S	.	.	H	α-helix	trans	-62.1	-56.2	175	-179	-89.8	0	0	0	111.4	M1531 M1535 F1652 S1653 K1654 E1658 I1659 E1660	M1531-Y1656 HydrophobicContact CE-CD2 3.47Å; M1531-Y1656 VanDerWaalsContact CE-CD2 3.47Å; M1531-Y1656 HydrophobicContact CE-CE2 3.68Å; M1531-Y1656 HydrophobicContact CE-CG 3.97Å; M1531-Y1656 WeakPolarHBondContact CE-O 3.27Å; M1531-Y1656 HydrophobicContact SD-CD2 3.14Å; M1531-Y1656 WeakPolarHBondContact SD-CD2 2.99Å; M1531-Y1656 HydrophobicContact SD-CE2 3.53Å; M1531-Y1656 VanDerWaalsContact SD-CE2 3.53Å; M1531-Y1656 HydrophobicContact SD-CG 4.05Å; M1535-Y1656 HydrophobicContact CE-CD2 4.09Å; M1535-Y1656 HydrophobicContact CE-CG 4.31Å; F1652-Y1656 WeakPolarHBondContact O-CB 3.16Å; F1652-Y1656 PolarHBondContact O-N 2.9Å; S1653-Y1656 WeakPolarHBondContact O-CB 3.26Å; S1653-Y1656 PolarHBondContact O-N 3.46Å; K1654-Y1656 VanDerWaalsContact C-N 3.28Å; K1654-Y1656 PolarHBondContact O-N 3.06Å; Y1656-E1658 PolarHBondContact O-N 3.11Å; Y1656-I1659 PolarHBondContact O-N 3.01Å; Y1656-E1660 HydrophobicContact CE1-CB 4.4Å; Y1656-E1660 VanDerWaalsContact CE1-CD 3.5Å; Y1656-E1660 WeakPolarHBondContact CE1-OE2 3.27Å; Y1656-E1660 WeakPolarHBondContact O-CB 3.42Å; Y1656-E1660 PolarHBondContact O-N 3.32Å; Y1656-E1660 PolarHBondContact OH-OE1 2.91Å
1657	E	88	Confident	86.7	Confident	120 Å²	120	70.9 Å²	70.9	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-62.1	-42.5	-175.9	-72.3	167.9	-156.6	0	0	112.6	S1653 I1659 E1660 S1661	S1653-E1657 WeakPolarHBondContact O-CG 3.15Å; S1653-E1657 PolarHBondContact O-N 3.01Å; S1653-E1657 PolarHBondContact OG-OE1 3.43Å; E1657-I1659 VanDerWaalsContact C-N 3.33Å; E1657-I1659 PolarHBondContact O-N 3.4Å; E1657-E1660 PolarHBondContact O-N 2.87Å; E1657-S1661 PolarHBondContact O-N 3.49Å
1658	E	83.7	Confident	86.5	Confident	126 Å²	126	68.6 Å²	68.6	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-60.1	-43.5	179.5	-170.9	-172.8	159.8	0	0	111.5	K1654 Y1656 S1661	K1654-E1658 PolarHBondContact O-N 3.15Å; Y1656-E1658 PolarHBondContact O-N 3.11Å; E1658-S1661 PolarHBondContact O-OG 3.19Å
1659	I	81	Confident	86.3	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.036	35%	0.352	C	S	.	.	H	α-helix	trans	-79.4	-35.9	-177.5	-61.8	165.3	0	0	0	111.3	M1531 K1534 T1655 Y1656 E1657 S1661 A1662 S1663	M1531-I1659 HydrophobicContact CB-CD1 4.25Å; M1531-I1659 HydrophobicContact CB-CG2 4.36Å; M1531-I1659 HydrophobicContact CE-CB 4.21Å; M1531-I1659 HydrophobicContact CE-CG2 4.31Å; M1531-I1659 HydrophobicContact CG-CD1 4.23Å; K1534-I1659 HydrophobicContact CB-CD1 3.8Å; K1534-I1659 HydrophobicContact CD-CD1 3.36Å; K1534-I1659 HydrophobicContact CD-CG1 3.98Å; K1534-I1659 HydrophobicContact CG-CD1 4.07Å; T1655-I1659 HydrophobicContact CG2-CD1 3.71Å; T1655-I1659 VanDerWaalsContact O-CD1 3.29Å; T1655-I1659 WeakPolarHBondContact O-CD1 3.42Å; T1655-I1659 VanDerWaalsContact O-CG1 3.31Å; T1655-I1659 WeakPolarHBondContact O-CG1 3.44Å; T1655-I1659 PolarHBondContact O-N 2.96Å; Y1656-I1659 PolarHBondContact O-N 3.01Å; E1657-I1659 VanDerWaalsContact C-N 3.33Å; E1657-I1659 PolarHBondContact O-N 3.4Å; I1659-S1661 VanDerWaalsContact C-N 3.31Å; I1659-S1661 PolarHBondContact O-N 3.45Å; I1659-A1662 CarbonylContact O-C 3.43Å; I1659-A1662 PolarHBondContact O-N 3.07Å; I1659-S1663 WeakPolarHBondContact O-CA 3.34Å; I1659-S1663 PolarHBondContact O-N 2.87Å
1660	E	84.2	Confident	85.8	Confident	93 Å²	93	66.2 Å²	66.2	44%	0.435	34%	0.336	S	S	.	.	H	α-helix	trans	-60	-42.3	-179.9	-172.8	172.4	-136.3	0	0	111.3	M1531 Y1656 E1657 A1662 S1663	M1531-E1660 HydrophobicContact CE-CB 4.38Å; Y1656-E1660 HydrophobicContact CE1-CB 4.4Å; Y1656-E1660 VanDerWaalsContact CE1-CD 3.5Å; Y1656-E1660 WeakPolarHBondContact CE1-OE2 3.27Å; Y1656-E1660 WeakPolarHBondContact O-CB 3.42Å; Y1656-E1660 PolarHBondContact O-N 3.32Å; Y1656-E1660 PolarHBondContact OH-OE1 2.91Å; E1657-E1660 PolarHBondContact O-N 2.87Å; E1660-A1662 PolarHBondContact O-N 3.11Å; E1660-A1662 VanDerWaalsContact O-N 3.12Å; E1660-S1663 VanDerWaalsContact O-CB 3.29Å; E1660-S1663 WeakPolarHBondContact O-CB 3.44Å; E1660-S1663 PolarHBondContact O-N 3.4Å; E1660-S1663 VanDerWaalsContact O-N 3.11Å; E1660-S1663 PolarHBondContact O-OG 3.3Å
1661	S	82.3	Confident	85.6	Confident	97 Å²	97	65.2 Å²	65.2	68%	0.678	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.9	178.5	74.5	0	0	0	0	114.2	E1657 E1658 I1659	E1657-S1661 PolarHBondContact O-N 3.49Å; E1658-S1661 PolarHBondContact O-OG 3.19Å; I1659-S1661 VanDerWaalsContact C-N 3.31Å; I1659-S1661 PolarHBondContact O-N 3.45Å
1662	A	80.3	Confident	85.5	Confident	24 Å²	24	62.3 Å²	62.3	20%	0.198	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	7.9	-179.1	0	0	0	0	0	113.6	I1659 E1660 T1664 Y1665 Y1666	I1659-A1662 CarbonylContact O-C 3.43Å; I1659-A1662 PolarHBondContact O-N 3.07Å; E1660-A1662 PolarHBondContact O-N 3.11Å; E1660-A1662 VanDerWaalsContact O-N 3.12Å; A1662-T1664 VanDerWaalsContact C-N 3.33Å; A1662-T1664 PolarHBondContact O-N 3.12Å; A1662-Y1665 PolarHBondContact O-N 3.44Å; A1662-Y1666 HydrophobicContact CB-CD2 3.8Å; A1662-Y1666 HydrophobicContact CB-CE2 3.54Å; A1662-Y1666 WeakPolarHBondContact O-CD2 3.14Å; A1662-Y1666 PolarHBondContact O-N 3.08Å
1663	S	82.6	Confident	85.1	Confident	27 Å²	27	61.7 Å²	61.7	19%	0.189	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-38.7	-170.2	59.2	0	0	0	0	113.6	I1659 E1660 Y1666 W1667	I1659-S1663 WeakPolarHBondContact O-CA 3.34Å; I1659-S1663 PolarHBondContact O-N 2.87Å; E1660-S1663 VanDerWaalsContact O-CB 3.29Å; E1660-S1663 WeakPolarHBondContact O-CB 3.44Å; E1660-S1663 PolarHBondContact O-N 3.4Å; E1660-S1663 VanDerWaalsContact O-N 3.11Å; E1660-S1663 PolarHBondContact O-OG 3.3Å; S1663-Y1666 PolarHBondContact O-N 3.28Å; S1663-W1667 WeakPolarHBondContact O-CB 3.38Å; S1663-W1667 PolarHBondContact O-N 3.19Å
1664	T	82.1	Confident	84.7	Confident	85 Å²	85	59.3 Å²	59.3	52%	0.521	29%	0.286	S	S	.	.	H	α-helix	trans	-65.3	-44.3	178.4	54	0	0	0	0	111.7	A1662 W1667 N1668	A1662-T1664 VanDerWaalsContact C-N 3.33Å; A1662-T1664 PolarHBondContact O-N 3.12Å; T1664-W1667 PolarHBondContact O-N 3.02Å; T1664-N1668 WeakPolarHBondContact O-CB 3.43Å; T1664-N1668 VanDerWaalsContact O-CG 3.23Å; T1664-N1668 PolarHBondContact O-N 3.2Å; T1664-N1668 PolarHBondContact O-ND2 2.9Å
1665	Y	84.4	Confident	84.5	Confident	111 Å²	111	52.4 Å²	52.4	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-46	175.9	-65.9	-65.6	0	0	0	111.6	A1271 A1662 N1668 Y1669	A1271-Y1665 HydrophobicContact CB-CD1 3.47Å; A1271-Y1665 VanDerWaalsContact CB-CD1 3.47Å; A1271-Y1665 HydrophobicContact CB-CE1 3.92Å; A1662-Y1665 PolarHBondContact O-N 3.44Å; Y1665-N1668 PolarHBondContact O-N 3.41Å; Y1665-Y1669 PolarHBondContact O-N 3.1Å; Y1665-Y1669 VanDerWaalsContact O-N 3.11Å
1666	Y	81.9	Confident	84.3	Confident	79 Å²	79	53.6 Å²	53.6	31%	0.31	26%	0.262	S	S	.	.	H	α-helix	trans	-64.5	-42.8	177.1	-75.6	-64.2	0	0	0	112.3	I1267 A1662 S1663 Y1669 Q1670	I1267-Y1666 HydrophobicContact CD1-CE1 4.01Å; A1662-Y1666 HydrophobicContact CB-CD2 3.8Å; A1662-Y1666 HydrophobicContact CB-CE2 3.54Å; A1662-Y1666 WeakPolarHBondContact O-CD2 3.14Å; A1662-Y1666 PolarHBondContact O-N 3.08Å; S1663-Y1666 PolarHBondContact O-N 3.28Å; Y1666-Y1669 PolarHBondContact O-N 3.48Å; Y1666-Q1670 WeakPolarHBondContact O-CG 3.33Å; Y1666-Q1670 PolarHBondContact O-N 2.98Å
1667	W	84.2	Confident	83.9	Confident	29 Å²	29	50.2 Å²	50.2	11%	0.11	25%	0.25	C	C	.	.	H	α-helix	trans	-63.1	-44.3	176.8	-178.9	75	0	0	0	111.9	F1521 I1523 P1527 S1663 T1664 Y1669 Q1670 R1671	F1521-W1667 PolarHBondContact O-NE1 3Å; I1523-W1667 VanDerWaalsContact CA-CE2 3.47Å; I1523-W1667 HydrophobicContact CB-CD2 4.27Å; I1523-W1667 HydrophobicContact CB-CH2 4.15Å; I1523-W1667 HydrophobicContact CB-CZ2 3.76Å; I1523-W1667 HydrophobicContact CD1-CE3 4.07Å; I1523-W1667 HydrophobicContact CD1-CH2 3.88Å; I1523-W1667 HydrophobicContact CD1-CZ2 4.36Å; I1523-W1667 HydrophobicContact CD1-CZ3 3.73Å; I1523-W1667 HydrophobicContact CG1-CD2 3.83Å; I1523-W1667 HydrophobicContact CG1-CE3 3.85Å; I1523-W1667 HydrophobicContact CG1-CG 4.47Å; I1523-W1667 HydrophobicContact CG1-CH2 4Å; I1523-W1667 HydrophobicContact CG1-CZ2 4Å; I1523-W1667 HydrophobicContact CG1-CZ3 3.95Å; P1527-W1667 HydrophobicContact CG-CB 3.91Å; S1663-W1667 WeakPolarHBondContact O-CB 3.38Å; S1663-W1667 PolarHBondContact O-N 3.19Å; T1664-W1667 PolarHBondContact O-N 3.02Å; W1667-Y1669 VanDerWaalsContact C-N 3.26Å; W1667-Y1669 PolarHBondContact O-N 3.46Å; W1667-Q1670 PolarHBondContact O-N 3.01Å; W1667-R1671 WeakPolarHBondContact O-CB 3.47Å; W1667-R1671 PolarHBondContact O-N 3.4Å
1668	N	85.9	Confident	83.6	Confident	30 Å²	30	45 Å²	45	16%	0.16	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-39.3	176.6	-79.3	-16.1	0	0	0	112.3	A1271 Q1276 T1664 Y1665	A1271-N1668 HydrophobicContact CB-CB 4.19Å; Q1276-N1668 PolarHBondContact NE2-O 3.32Å; T1664-N1668 WeakPolarHBondContact O-CB 3.43Å; T1664-N1668 VanDerWaalsContact O-CG 3.23Å; T1664-N1668 PolarHBondContact O-N 3.2Å; T1664-N1668 PolarHBondContact O-ND2 2.9Å; Y1665-N1668 PolarHBondContact O-N 3.41Å
1669	Y	85.5	Confident	83.6	Confident	32 Å²	32	40 Å²	40	13%	0.125	20%	0.203	C	C	.	.	H	α-helix	trans	-71.1	-43.3	174.8	180	-105.1	0	0	0	112.7	A1262 M1270 Y1665 Y1666 W1667 R1671 Y1672 Q1673	A1262-Y1669 HydrophobicContact CB-CE2 4.42Å; A1262-Y1669 WeakPolarHBondContact O-CE2 3.3Å; A1262-Y1669 PolarHBondContact O-OH 3.26Å; M1270-Y1669 HydrophobicContact CB-CD2 4.44Å; M1270-Y1669 HydrophobicContact CG-CD2 4.22Å; Y1665-Y1669 PolarHBondContact O-N 3.1Å; Y1665-Y1669 VanDerWaalsContact O-N 3.11Å; Y1666-Y1669 PolarHBondContact O-N 3.48Å; W1667-Y1669 VanDerWaalsContact C-N 3.26Å; W1667-Y1669 PolarHBondContact O-N 3.46Å; Y1669-R1671 VanDerWaalsContact C-N 3.29Å; Y1669-R1671 PolarHBondContact O-N 3.25Å; Y1669-Y1672 WeakPolarHBondContact O-CB 3.19Å; Y1669-Y1672 PolarHBondContact O-N 2.92Å; Y1669-Q1673 HydrophobicContact CE1-CG 4.45Å; Y1669-Q1673 PolarHBondContact O-N 3.47Å; Y1669-Q1673 PolarHBondContact OH-NE2 3.48Å
1670	Q	81.1	Confident	83.3	Confident	50 Å²	50	42 Å²	42	23%	0.234	21%	0.212	C	C	.	.	H	α-helix	trans	-62.8	-36.5	175.8	-76.1	-169.8	-30.7	0	0	112.7	I1530 Y1666 W1667 Y1672 Q1673 M1674	I1530-Q1670 HydrophobicContact CD1-CG 4.37Å; Y1666-Q1670 WeakPolarHBondContact O-CG 3.33Å; Y1666-Q1670 PolarHBondContact O-N 2.98Å; W1667-Q1670 PolarHBondContact O-N 3.01Å; Q1670-Y1672 VanDerWaalsContact C-N 3.27Å; Q1670-Y1672 PolarHBondContact O-N 3.25Å; Q1670-Q1673 WeakPolarHBondContact O-CB 3.17Å; Q1670-Q1673 PolarHBondContact O-N 2.99Å; Q1670-Q1673 VanDerWaalsContact O-N 3.08Å; Q1670-M1674 PolarHBondContact O-N 3.28Å
1671	R	87.9	Confident	82.9	Confident	37 Å²	37	40 Å²	40	14%	0.14	20%	0.2	C	C	.	.	H	α-helix	trans	-56.2	-42.9	175.2	-172.1	-175.2	-179.3	-160.7	0.3	111.3	T1280 F1521 W1667 Y1669 I1675	T1280-R1671 PolarHBondContact OG1-NH2 3.11Å; F1521-R1671 HydrophobicContact CD2-CG 4.5Å; F1521-R1671 HydrophobicContact CE2-CB 4.37Å; F1521-R1671 HydrophobicContact CE2-CG 3.67Å; F1521-R1671 HydrophobicContact CZ-CG 4.02Å; W1667-R1671 WeakPolarHBondContact O-CB 3.47Å; W1667-R1671 PolarHBondContact O-N 3.4Å; Y1669-R1671 VanDerWaalsContact C-N 3.29Å; Y1669-R1671 PolarHBondContact O-N 3.25Å; R1671-I1675 HydrophobicContact CG-CD1 3.91Å; R1671-I1675 WeakPolarHBondContact O-CD1 3.5Å; R1671-I1675 WeakPolarHBondContact O-CG1 3.49Å; R1671-I1675 PolarHBondContact O-N 2.76Å
1672	Y	87.8	Confident	82.7	Confident	13 Å²	13	35.8 Å²	35.8	5%	0.051	17%	0.171	C	C	.	.	H	α-helix	trans	-57.5	-50.1	173.1	168	-91.9	0	0	0	111.7	I1258 A1262 M1270 L1279 Y1669 Q1670 M1674 I1675 N1676 F1719	I1258-Y1672 HydrophobicContact CD1-CD2 4.02Å; I1258-Y1672 HydrophobicContact CD1-CE2 3.99Å; I1258-Y1672 HydrophobicContact CG1-CD2 4.11Å; I1258-Y1672 HydrophobicContact CG1-CE2 3.82Å; A1262-Y1672 HydrophobicContact CB-CD1 3.81Å; A1262-Y1672 HydrophobicContact CB-CE1 3.33Å; A1262-Y1672 HydrophobicContact CB-CE2 4.37Å; M1270-Y1672 HydrophobicContact CE-CD1 4.3Å; M1270-Y1672 HydrophobicContact CE-CD2 3.55Å; M1270-Y1672 HydrophobicContact CE-CE2 4.3Å; M1270-Y1672 HydrophobicContact CE-CG 3.57Å; L1279-Y1672 HydrophobicContact CD1-CD2 4.46Å; L1279-Y1672 HydrophobicContact CD2-CD2 3.84Å; Y1669-Y1672 WeakPolarHBondContact O-CB 3.19Å; Y1669-Y1672 PolarHBondContact O-N 2.92Å; Q1670-Y1672 VanDerWaalsContact C-N 3.27Å; Q1670-Y1672 PolarHBondContact O-N 3.25Å; Y1672-M1674 PolarHBondContact O-N 3.3Å; Y1672-I1675 PolarHBondContact O-N 3.2Å; Y1672-N1676 WeakPolarHBondContact O-CB 3.49Å; Y1672-N1676 PolarHBondContact O-N 2.88Å; Y1672-F1719 AromaticContact CD2-CE1 4Å; Y1672-F1719 HydrophobicContact CD2-CE1 4Å; Y1672-F1719 AromaticContact CE2-CD1 3.82Å; Y1672-F1719 HydrophobicContact CE2-CD1 3.82Å; Y1672-F1719 AromaticContact CE2-CE1 3.63Å; Y1672-F1719 HydrophobicContact CE2-CE1 3.63Å; Y1672-F1719 HydrophobicContact CE2-CZ 4.35Å
1673	Q	83.9	Confident	82.5	Confident	47 Å²	47	35.1 Å²	35.1	22%	0.22	17%	0.165	C	C	.	.	H	α-helix	trans	-58.9	-46.1	-177	-67.1	-177.7	-19.4	0	0	111.7	Y1669 Q1670 N1676 D1677	Y1669-Q1673 HydrophobicContact CE1-CG 4.45Å; Y1669-Q1673 PolarHBondContact O-N 3.47Å; Y1669-Q1673 PolarHBondContact OH-NE2 3.48Å; Q1670-Q1673 WeakPolarHBondContact O-CB 3.17Å; Q1670-Q1673 PolarHBondContact O-N 2.99Å; Q1670-Q1673 VanDerWaalsContact O-N 3.08Å; Q1673-N1676 PolarHBondContact O-N 3.34Å; Q1673-D1677 VanDerWaalsContact O-CG 3.25Å; Q1673-D1677 PolarHBondContact O-N 3.14Å; Q1673-D1677 VanDerWaalsContact O-N 3.12Å
1674	M	83.2	Confident	82.4	Confident	6 Å²	6	36.6 Å²	36.6	3%	0.03	17%	0.17	C	C	.	.	H	α-helix	trans	-71.8	-33.5	179.4	-150.4	-158.7	76.1	0	0	112.9	W1283 F1385 F1521 Q1670 Y1672 D1677 Y1678	W1283-M1674 HydrophobicContact CH2-CE 3.61Å; W1283-M1674 HydrophobicContact CZ2-CE 4.47Å; W1283-M1674 HydrophobicContact CZ3-CE 4.11Å; F1385-M1674 HydrophobicContact CD2-CE 3.55Å; F1385-M1674 HydrophobicContact CD2-SD 4.35Å; F1385-M1674 HydrophobicContact CE2-CE 3.65Å; F1385-M1674 HydrophobicContact CE2-SD 4.03Å; F1385-M1674 HydrophobicContact CG-CE 4.29Å; F1385-M1674 HydrophobicContact CZ-CE 4.45Å; F1521-M1674 HydrophobicContact CB-CE 3.82Å; F1521-M1674 HydrophobicContact CB-SD 3.75Å; F1521-M1674 HydrophobicContact CD1-CE 3.89Å; F1521-M1674 HydrophobicContact CD2-CB 3.89Å; F1521-M1674 HydrophobicContact CD2-CE 3.33Å; F1521-M1674 HydrophobicContact CD2-CG 4.41Å; F1521-M1674 HydrophobicContact CD2-SD 3.74Å; F1521-M1674 HydrophobicContact CE1-CE 4.25Å; F1521-M1674 HydrophobicContact CE2-CB 4.14Å; F1521-M1674 HydrophobicContact CE2-CE 3.73Å; F1521-M1674 HydrophobicContact CG-CE 3.41Å; F1521-M1674 VanDerWaalsContact CG-CE 3.41Å; F1521-M1674 HydrophobicContact CG-SD 3.92Å; F1521-M1674 HydrophobicContact CZ-CE 4.16Å; Q1670-M1674 PolarHBondContact O-N 3.28Å; Y1672-M1674 PolarHBondContact O-N 3.3Å; M1674-D1677 PolarHBondContact O-N 2.77Å; M1674-Y1678 HydrophobicContact CE-CD2 3.72Å; M1674-Y1678 HydrophobicContact CE-CE2 3.68Å; M1674-Y1678 HydrophobicContact CG-CD2 3.93Å; M1674-Y1678 HydrophobicContact CG-CE2 3.79Å; M1674-Y1678 WeakPolarHBondContact O-CD2 3.47Å; M1674-Y1678 PolarHBondContact O-N 3.01Å; M1674-Y1678 VanDerWaalsContact O-N 3.16Å; M1674-Y1678 HydrophobicContact SD-CD2 4.28Å; M1674-Y1678 HydrophobicContact SD-CE2 3.82Å
1675	I	87.5	Confident	82.3	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-45.1	173.6	-65	167.3	0	0	0	110	L1279 T1282 W1283 F1521 R1671 Y1672 D1677 Y1678 V1679 F1719	L1279-I1675 HydrophobicContact CB-CD1 3.8Å; L1279-I1675 HydrophobicContact CD2-CD1 3.98Å; L1279-I1675 HydrophobicContact CG-CD1 4.37Å; T1282-I1675 HydrophobicContact CG2-CG2 4.13Å; W1283-I1675 HydrophobicContact CB-CD1 4.2Å; W1283-I1675 HydrophobicContact CB-CG1 4.43Å; W1283-I1675 HydrophobicContact CD2-CG1 4.27Å; W1283-I1675 HydrophobicContact CE3-CB 4.33Å; W1283-I1675 HydrophobicContact CE3-CG1 3.67Å; W1283-I1675 HydrophobicContact CE3-CG2 4.27Å; W1283-I1675 HydrophobicContact CZ3-CG1 4.23Å; F1521-I1675 HydrophobicContact CE2-CD1 4.46Å; F1521-I1675 HydrophobicContact CE2-CG1 3.94Å; F1521-I1675 HydrophobicContact CZ-CD1 4.25Å; F1521-I1675 HydrophobicContact CZ-CG1 3.88Å; R1671-I1675 HydrophobicContact CG-CD1 3.91Å; R1671-I1675 WeakPolarHBondContact O-CD1 3.5Å; R1671-I1675 WeakPolarHBondContact O-CG1 3.49Å; R1671-I1675 PolarHBondContact O-N 2.76Å; Y1672-I1675 PolarHBondContact O-N 3.2Å; I1675-D1677 VanDerWaalsContact C-N 3.26Å; I1675-D1677 PolarHBondContact O-N 2.96Å; I1675-Y1678 PolarHBondContact O-N 2.78Å; I1675-V1679 HydrophobicContact CG2-CG2 4.1Å; I1675-V1679 WeakPolarHBondContact O-CG2 3.39Å; I1675-V1679 PolarHBondContact O-N 2.77Å; I1675-F1719 HydrophobicContact CB-CZ 4.48Å; I1675-F1719 HydrophobicContact CG2-CZ 3.85Å
1676	N	84.5	Confident	81.8	Confident	25 Å²	25	28.8 Å²	28.8	13%	0.134	14%	0.136	C	C	.	.	H	α-helix	trans	-55.8	-43.4	177.7	-173.2	48.1	0	0	0	111.9	Y1672 Q1673 H1680 F1719	Y1672-N1676 WeakPolarHBondContact O-CB 3.49Å; Y1672-N1676 PolarHBondContact O-N 2.88Å; Q1673-N1676 PolarHBondContact O-N 3.34Å; N1676-H1680 PolarHBondContact O-N 3.01Å; N1676-F1719 HydrophobicContact CB-CE2 4.06Å; N1676-F1719 HydrophobicContact CB-CZ 4.26Å
1677	D	78.9	Confident	81.3	Confident	17 Å²	17	27 Å²	27	9%	0.091	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-47.6	177.3	-74.9	-3.7	0	0	0	113.5	R993 Q1673 M1674 I1675 H1680 R1681	R993-D1677 WeakPolarHBondContact CG-OD1 3.23Å; R993-D1677 VanDerWaalsContact CZ-CG 3.44Å; R993-D1677 IonicContact CZ-OD1 2.87Å; R993-D1677 IonicContact CZ-OD2 3.77Å; R993-D1677 VanDerWaalsContact CZ-OD2 3.3Å; R993-D1677 IonicContact NE-OD1 2.71Å; R993-D1677 PolarHBondContact NE-OD1 3Å; R993-D1677 IonicContact NE-OD2 3.85Å; R993-D1677 PolarHBondContact NE-OD2 3.36Å; R993-D1677 VanDerWaalsContact NH2-CB 3.32Å; R993-D1677 IonicContact NH2-OD1 3.66Å; R993-D1677 IonicContact NH2-OD2 2.97Å; R993-D1677 PolarHBondContact NH2-OD2 3.42Å; Q1673-D1677 VanDerWaalsContact O-CG 3.25Å; Q1673-D1677 PolarHBondContact O-N 3.14Å; Q1673-D1677 VanDerWaalsContact O-N 3.12Å; M1674-D1677 PolarHBondContact O-N 2.77Å; I1675-D1677 VanDerWaalsContact C-N 3.26Å; I1675-D1677 PolarHBondContact O-N 2.96Å; D1677-H1680 PolarHBondContact O-N 2.98Å; D1677-R1681 PolarHBondContact O-N 2.76Å; D1677-R1681 VanDerWaalsContact O-N 3.17Å
1678	Y	83.5	Confident	81.2	Confident	11 Å²	11	30.7 Å²	30.7	4%	0.043	16%	0.155	C	C	.	.	H	α-helix	trans	-77.5	-23.6	-177.9	-81.6	-80.5	0	0	0	114.3	R1384 F1385 N1388 M1674 I1675 H1680	R1384-Y1678 PolarHBondContact NH1-O 2.91Å; F1385-Y1678 HydrophobicContact CB-CD1 4.05Å; F1385-Y1678 HydrophobicContact CB-CE1 4.06Å; F1385-Y1678 HydrophobicContact CB-CG 4.31Å; F1385-Y1678 HydrophobicContact CD2-CD2 4.19Å; F1385-Y1678 HydrophobicContact CD2-CE1 4.03Å; F1385-Y1678 AromaticContact CD2-CE2 3.57Å; F1385-Y1678 HydrophobicContact CD2-CE2 3.57Å; F1385-Y1678 AromaticContact CD2-CZ 3.47Å; F1385-Y1678 VanDerWaalsContact CD2-CZ 3.47Å; F1385-Y1678 HydrophobicContact CE2-CE2 4.28Å; N1388-Y1678 HydrophobicContact CB-CE1 4.31Å; M1674-Y1678 HydrophobicContact CE-CD2 3.72Å; M1674-Y1678 HydrophobicContact CE-CE2 3.68Å; M1674-Y1678 HydrophobicContact CG-CD2 3.93Å; M1674-Y1678 HydrophobicContact CG-CE2 3.79Å; M1674-Y1678 WeakPolarHBondContact O-CD2 3.47Å; M1674-Y1678 PolarHBondContact O-N 3.01Å; M1674-Y1678 VanDerWaalsContact O-N 3.16Å; M1674-Y1678 HydrophobicContact SD-CD2 4.28Å; M1674-Y1678 HydrophobicContact SD-CE2 3.82Å; I1675-Y1678 PolarHBondContact O-N 2.78Å; Y1678-H1680 VanDerWaalsContact C-N 3.31Å
1679	V	83.6	Confident	81	Confident	20 Å²	20	29.3 Å²	29.3	12%	0.121	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-39.9	171	168.3	0	0	0	0	110.4	T1282 P1381 R1384 I1675 P1718 F1719	T1282-V1679 HydrophobicContact CG2-CG2 4.08Å; P1381-V1679 HydrophobicContact CB-CG2 4.27Å; P1381-V1679 HydrophobicContact CG-CG2 3.61Å; R1384-V1679 PolarHBondContact NH1-O 3.13Å; I1675-V1679 HydrophobicContact CG2-CG2 4.1Å; I1675-V1679 WeakPolarHBondContact O-CG2 3.39Å; I1675-V1679 PolarHBondContact O-N 2.77Å; V1679-P1718 HydrophobicContact CB-CG 4.48Å; V1679-P1718 VanDerWaalsContact CG1-CD 3.44Å; V1679-P1718 HydrophobicContact CG1-CG 3.5Å; V1679-P1718 VanDerWaalsContact CG1-CG 3.5Å; V1679-P1718 HydrophobicContact CG2-CG 4.13Å; V1679-F1719 HydrophobicContact CB-CE2 4.27Å; V1679-F1719 HydrophobicContact CG1-CE2 4.42Å; V1679-F1719 HydrophobicContact CG2-CE2 4.02Å
1680	H	74	Confident	80.8	Confident	48 Å²	48	30.5 Å²	30.5	22%	0.222	16%	0.156	C	C	.	.	H	α-helix	trans	-85.7	-12.9	-178.6	-64.6	6.9	0	0	0	113.4	H991 W1435 N1676 D1677 Y1678	H991-H1680 AromaticContact CE1-CE1 3.8Å; H991-H1680 AromaticContact CE1-NE2 3.9Å; H991-H1680 AromaticContact CG-NE2 3.81Å; H991-H1680 AromaticContact ND1-CD2 3.5Å; H991-H1680 AromaticContact ND1-CE1 3.22Å; H991-H1680 PolarHBondContact ND1-CE1 2.86Å; H991-H1680 AromaticContact ND1-CG 3.99Å; H991-H1680 AromaticContact ND1-ND1 3.8Å; H991-H1680 AromaticContact ND1-NE2 2.91Å; H991-H1680 PolarHBondContact ND1-NE2 2.85Å; W1435-H1680 HydrophobicContact CH2-CB 3.9Å; W1435-H1680 AromaticContact CH2-CD2 3.81Å; W1435-H1680 HydrophobicContact CZ2-CB 4.14Å; W1435-H1680 AromaticContact CZ2-CD2 3.79Å; N1676-H1680 PolarHBondContact O-N 3.01Å; D1677-H1680 PolarHBondContact O-N 2.98Å; Y1678-H1680 VanDerWaalsContact C-N 3.31Å
1681	R	75.8	Confident	81	Confident	51 Å²	51	32.3 Å²	32.3	19%	0.192	17%	0.17	C	C	.	.	S	Bend	trans	-73.8	150.1	177.2	-160.1	169.9	-169.1	165.4	3	113	R1384 N1388 E1428 D1677	R1384-R1681 PolarHBondContact NH1-O 3.49Å; N1388-R1681 PolarHBondContact ND2-NH1 2.75Å; N1388-R1681 VanDerWaalsContact OD1-CZ 3.3Å; N1388-R1681 PolarHBondContact OD1-NH2 2.64Å; E1428-R1681 IonicContact OE1-NE 2.73Å; D1677-R1681 PolarHBondContact O-N 2.76Å; D1677-R1681 VanDerWaalsContact O-N 3.17Å
1682	S	77.6	Confident	80.7	Confident	9 Å²	9	33.4 Å²	33.4	6%	0.063	17%	0.174	C	C	.	.			trans	-62.6	146	177.8	-57.5	0	0	0	0	111.7	K1431 L1684	K1431-S1682 PolarHBondContact NZ-OG 2.96Å; S1682-L1684 PolarHBondContact O-N 2.78Å
1683	P	76.1	Confident	80.2	Confident	11 Å²	11	34 Å²	34	7%	0.071	18%	0.177	C	C	.	.	S	Bend	trans	-74.5	-22.6	-173.9	28.8	-35.3	0	0	0	114.4	M1379 W1692	M1379-P1683 HydrophobicContact CE-CB 3.9Å; M1379-P1683 HydrophobicContact CE-CG 3.79Å; M1379-P1683 HydrophobicContact SD-CB 4.38Å; P1683-W1692 VanDerWaalsContact CD-CE2 3.45Å; P1683-W1692 HydrophobicContact CG-CD2 3.68Å; P1683-W1692 HydrophobicContact CG-CE3 3.79Å; P1683-W1692 HydrophobicContact CG-CG 4.38Å; P1683-W1692 HydrophobicContact CG-CH2 3.83Å; P1683-W1692 HydrophobicContact CG-CZ2 3.71Å; P1683-W1692 HydrophobicContact CG-CZ3 3.86Å
1684	L	80.9	Confident	80.1	Confident	58 Å²	58	38.4 Å²	38.4	30%	0.304	20%	0.196	S	C	.	.	S	Bend	trans	-88.7	133.9	177.8	-63.9	-179.3	0	0	0	110	S1682 I1688 I1689 V1691 W1692	S1682-L1684 PolarHBondContact O-N 2.78Å; L1684-I1688 HydrophobicContact CD1-CG2 4.1Å; L1684-I1689 WeakPolarHBondContact O-CG1 3.45Å; L1684-V1691 HydrophobicContact CD1-CB 4.48Å; L1684-W1692 HydrophobicContact CB-CB 4.41Å; L1684-W1692 HydrophobicContact CD1-CB 3.82Å; L1684-W1692 HydrophobicContact CD1-CE3 4.43Å; L1684-W1692 HydrophobicContact CG-CB 4.24Å
1685	A	80.4	Confident	80.1	Confident	25 Å²	25	43.6 Å²	43.6	21%	0.207	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-72.6	150.6	171.3	0	0	0	0	0	110.9	I1688 I1689	A1685-I1688 PolarHBondContact O-N 2.8Å; A1685-I1689 PolarHBondContact O-N 2.81Å; A1685-I1689 VanDerWaalsContact O-N 3.15Å
1686	P	72.7	Confident	79.3	Confident	6 Å²	6	47.5 Å²	47.5	4%	0.039	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	146.9	169.3	-25.1	35.8	0	0	0	111.9	W1421 L1425 I1689	W1421-P1686 WeakPolarHBondContact CZ2-O 2.94Å; L1425-P1686 HydrophobicContact CD2-CG 4.23Å; P1686-I1689 HydrophobicContact CB-CG2 4.26Å; P1686-I1689 HydrophobicContact CG-CD1 4.44Å; P1686-I1689 HydrophobicContact CG-CG2 4.28Å
1687	P	72.4	Confident	78.8	Confident	41 Å²	41	48.4 Å²	48.4	27%	0.266	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.7	-6.6	-1	36.4	-35.1	0	0	0	113.4	W1421 T1424 I1689 I1690	W1421-P1687 HydrophobicContact CD2-CB 4.42Å; W1421-P1687 HydrophobicContact CD2-CG 4.25Å; W1421-P1687 HydrophobicContact CE3-CG 3.99Å; W1421-P1687 HydrophobicContact CZ3-CG 4.18Å; T1424-P1687 HydrophobicContact CG2-CB 3.85Å; P1687-I1689 PolarHBondContact O-N 3.48Å; P1687-I1690 PolarHBondContact O-N 3Å
1688	I	82.5	Confident	78.8	Confident	107 Å²	107	56 Å²	56	55%	0.549	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.3	-178.5	-41.8	177.6	0	0	0	111.2	L1684 A1685 I1690 V1691	L1684-I1688 HydrophobicContact CD1-CG2 4.1Å; A1685-I1688 PolarHBondContact O-N 2.8Å; I1688-I1690 PolarHBondContact O-N 3.25Å; I1688-V1691 HydrophobicContact CG2-CG2 4.22Å; I1688-V1691 WeakPolarHBondContact O-CB 3.37Å; I1688-V1691 PolarHBondContact O-N 3.3Å
1689	I	82.1	Confident	78.2	Confident	1 Å²	1	60 Å²	60	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-47.1	-32	170.4	-155.4	176.4	0	0	0	113.5	T1424 E1428 L1684 A1685 P1686 P1687 V1691 W1692 H1693	T1424-I1689 HydrophobicContact CG2-CG2 4.21Å; E1428-I1689 HydrophobicContact CB-CD1 4.45Å; E1428-I1689 HydrophobicContact CG-CD1 4.26Å; E1428-I1689 WeakPolarHBondContact OE2-CD1 3.42Å; L1684-I1689 WeakPolarHBondContact O-CG1 3.45Å; A1685-I1689 PolarHBondContact O-N 2.81Å; A1685-I1689 VanDerWaalsContact O-N 3.15Å; P1686-I1689 HydrophobicContact CB-CG2 4.26Å; P1686-I1689 HydrophobicContact CG-CD1 4.44Å; P1686-I1689 HydrophobicContact CG-CG2 4.28Å; P1687-I1689 PolarHBondContact O-N 3.48Å; I1689-V1691 VanDerWaalsContact C-N 3.26Å; I1689-V1691 PolarHBondContact O-N 3.1Å; I1689-W1692 CarbonylContact O-C 3.53Å; I1689-W1692 WeakPolarHBondContact O-CA 3.41Å; I1689-W1692 WeakPolarHBondContact O-CB 3.32Å; I1689-W1692 PolarHBondContact O-N 3.33Å; I1689-H1693 WeakPolarHBondContact CG1-NE2 3.15Å; I1689-H1693 PolarHBondContact O-CD2 3.01Å; I1689-H1693 PolarHBondContact O-N 3.3Å
1690	I	80.7	Confident	77.4	Confident	58 Å²	58	59.9 Å²	59.9	30%	0.297	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-34	179.1	-151.5	172	0	0	0	112.3	T1424 I1427 P1687 I1688 W1692 H1693 F1694	T1424-I1690 HydrophobicContact CG2-CB 4.3Å; I1427-I1690 HydrophobicContact CD1-CD1 4.33Å; P1687-I1690 PolarHBondContact O-N 3Å; I1688-I1690 PolarHBondContact O-N 3.25Å; I1690-W1692 VanDerWaalsContact C-N 3.3Å; I1690-W1692 PolarHBondContact O-N 3Å; I1690-H1693 PolarHBondContact O-N 2.99Å; I1690-F1694 HydrophobicContact CD1-CE2 3.98Å; I1690-F1694 HydrophobicContact CG1-CD2 4.02Å; I1690-F1694 HydrophobicContact CG1-CE2 3.69Å; I1690-F1694 WeakPolarHBondContact O-CD2 3.14Å; I1690-F1694 PolarHBondContact O-N 2.8Å
1691	V	84.6	Confident	77.3	Confident	88 Å²	88	63.5 Å²	63.5	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-37.1	176.4	-179.2	0	0	0	0	110.3	L1684 I1688 I1689 F1694 Y1695	L1684-V1691 HydrophobicContact CD1-CB 4.48Å; I1688-V1691 HydrophobicContact CG2-CG2 4.22Å; I1688-V1691 WeakPolarHBondContact O-CB 3.37Å; I1688-V1691 PolarHBondContact O-N 3.3Å; I1689-V1691 VanDerWaalsContact C-N 3.26Å; I1689-V1691 PolarHBondContact O-N 3.1Å; V1691-F1694 PolarHBondContact O-N 3.07Å; V1691-Y1695 WeakPolarHBondContact O-CB 3.41Å; V1691-Y1695 PolarHBondContact O-N 2.94Å
1692	W	81.9	Confident	76.7	Confident	59 Å²	59	63.4 Å²	63.4	22%	0.223	33%	0.327	C	S	.	.	H	α-helix	trans	-70.5	-40.4	174	-167.7	-92.7	0	0	0	111.6	M1379 P1683 L1684 I1689 I1690 F1694 Y1695 E1696	M1379-W1692 HydrophobicContact CE-CH2 3.88Å; M1379-W1692 HydrophobicContact CE-CZ3 4.36Å; P1683-W1692 VanDerWaalsContact CD-CE2 3.45Å; P1683-W1692 HydrophobicContact CG-CD2 3.68Å; P1683-W1692 HydrophobicContact CG-CE3 3.79Å; P1683-W1692 HydrophobicContact CG-CG 4.38Å; P1683-W1692 HydrophobicContact CG-CH2 3.83Å; P1683-W1692 HydrophobicContact CG-CZ2 3.71Å; P1683-W1692 HydrophobicContact CG-CZ3 3.86Å; L1684-W1692 HydrophobicContact CB-CB 4.41Å; L1684-W1692 HydrophobicContact CD1-CB 3.82Å; L1684-W1692 HydrophobicContact CD1-CE3 4.43Å; L1684-W1692 HydrophobicContact CG-CB 4.24Å; I1689-W1692 CarbonylContact O-C 3.53Å; I1689-W1692 WeakPolarHBondContact O-CA 3.41Å; I1689-W1692 WeakPolarHBondContact O-CB 3.32Å; I1689-W1692 PolarHBondContact O-N 3.33Å; I1690-W1692 VanDerWaalsContact C-N 3.3Å; I1690-W1692 PolarHBondContact O-N 3Å; W1692-F1694 VanDerWaalsContact C-N 3.32Å; W1692-F1694 PolarHBondContact O-N 2.64Å; W1692-Y1695 HydrophobicContact CD2-CD1 4.36Å; W1692-Y1695 HydrophobicContact CE3-CD1 4.29Å; W1692-Y1695 HydrophobicContact CH2-CD1 4.23Å; W1692-Y1695 HydrophobicContact CH2-CE1 4.14Å; W1692-Y1695 HydrophobicContact CZ2-CD1 4.29Å; W1692-Y1695 HydrophobicContact CZ2-CE1 4.34Å; W1692-Y1695 HydrophobicContact CZ3-CD1 4.23Å; W1692-Y1695 HydrophobicContact CZ3-CE1 4.45Å; W1692-Y1695 CarbonylContact O-C 3.45Å; W1692-Y1695 WeakPolarHBondContact O-CA 3.49Å; W1692-Y1695 WeakPolarHBondContact O-CB 3.29Å; W1692-Y1695 PolarHBondContact O-N 3.28Å; W1692-Y1695 VanDerWaalsContact O-N 3.1Å; W1692-E1696 VanDerWaalsContact CD1-CD 3.48Å; W1692-E1696 PolarHBondContact NE1-OE1 3.39Å; W1692-E1696 PolarHBondContact O-N 2.66Å
1693	H	77.9	Confident	75.8	Confident	25 Å²	25	64.4 Å²	64.4	12%	0.116	33%	0.332	C	S	.	.	H	α-helix	trans	-62.4	-39.8	173.2	-64.7	-38	0	0	0	111.9	E1428 I1689 I1690 Y1695 E1696 A1697	E1428-H1693 IonicContact OE2-CE1 3.84Å; E1428-H1693 PolarHBondContact OE2-CE1 3.3Å; E1428-H1693 IonicContact OE2-NE2 3.63Å; E1428-H1693 PolarHBondContact OE2-NE2 3.36Å; I1689-H1693 WeakPolarHBondContact CG1-NE2 3.15Å; I1689-H1693 PolarHBondContact O-CD2 3.01Å; I1689-H1693 PolarHBondContact O-N 3.3Å; I1690-H1693 PolarHBondContact O-N 2.99Å; H1693-Y1695 VanDerWaalsContact C-N 3.33Å; H1693-E1696 PolarHBondContact O-N 3.13Å; H1693-A1697 WeakPolarHBondContact O-CA 3.48Å; H1693-A1697 WeakPolarHBondContact O-CB 3.46Å; H1693-A1697 PolarHBondContact O-N 3.46Å
1694	F	81.7	Confident	74.6	Confident	141 Å²	141	68.6 Å²	68.6	62%	0.618	35%	0.351	S	S	*	.	H	α-helix	trans	-64.9	-36.9	171.5	-80.2	-61.9	0	0	0	111.8	I1690 V1691 W1692 Y1698	I1690-F1694 HydrophobicContact CD1-CE2 3.98Å; I1690-F1694 HydrophobicContact CG1-CD2 4.02Å; I1690-F1694 HydrophobicContact CG1-CE2 3.69Å; I1690-F1694 WeakPolarHBondContact O-CD2 3.14Å; I1690-F1694 PolarHBondContact O-N 2.8Å; V1691-F1694 PolarHBondContact O-N 3.07Å; W1692-F1694 VanDerWaalsContact C-N 3.32Å; W1692-F1694 PolarHBondContact O-N 2.64Å; F1694-Y1698 WeakPolarHBondContact O-CA 3.28Å; F1694-Y1698 WeakPolarHBondContact O-CB 3.29Å; F1694-Y1698 PolarHBondContact O-N 3.18Å
1695	Y	82	Confident	72.8	Confident	115 Å²	115	71.3 Å²	71.3	45%	0.451	37%	0.373	S	S	.	.	H	α-helix	trans	-67	-44.1	173.9	172.9	-101.7	0	0	0	112.2	V1691 W1692 H1693 K1699	V1691-Y1695 WeakPolarHBondContact O-CB 3.41Å; V1691-Y1695 PolarHBondContact O-N 2.94Å; W1692-Y1695 HydrophobicContact CD2-CD1 4.36Å; W1692-Y1695 HydrophobicContact CE3-CD1 4.29Å; W1692-Y1695 HydrophobicContact CH2-CD1 4.23Å; W1692-Y1695 HydrophobicContact CH2-CE1 4.14Å; W1692-Y1695 HydrophobicContact CZ2-CD1 4.29Å; W1692-Y1695 HydrophobicContact CZ2-CE1 4.34Å; W1692-Y1695 HydrophobicContact CZ3-CD1 4.23Å; W1692-Y1695 HydrophobicContact CZ3-CE1 4.45Å; W1692-Y1695 CarbonylContact O-C 3.45Å; W1692-Y1695 WeakPolarHBondContact O-CA 3.49Å; W1692-Y1695 WeakPolarHBondContact O-CB 3.29Å; W1692-Y1695 PolarHBondContact O-N 3.28Å; W1692-Y1695 VanDerWaalsContact O-N 3.1Å; H1693-Y1695 VanDerWaalsContact C-N 3.33Å; Y1695-K1699 HydrophobicContact CE1-CD 4.39Å; Y1695-K1699 WeakPolarHBondContact O-CB 3.25Å; Y1695-K1699 PolarHBondContact O-N 3.3Å
1696	E	72.6	Confident	70.8	Confident	82 Å²	82	72.5 Å²	72.5	38%	0.383	38%	0.383	S	S	.	.	H	α-helix	trans	-67.4	-41.3	176.1	-80.7	-175.3	166.7	0	0	111.6	W1692 H1693 K1699 A1700	W1692-E1696 VanDerWaalsContact CD1-CD 3.48Å; W1692-E1696 PolarHBondContact NE1-OE1 3.39Å; W1692-E1696 PolarHBondContact O-N 2.66Å; H1693-E1696 PolarHBondContact O-N 3.13Å; E1696-K1699 CarbonylContact O-C 3.45Å; E1696-K1699 PolarHBondContact O-N 2.96Å; E1696-A1700 WeakPolarHBondContact O-CB 3.13Å; E1696-A1700 PolarHBondContact O-N 3.35Å
1697	A	73.3	Confident	69.2	Low	43 Å²	43	74 Å²	74	36%	0.355	39%	0.394	S	S	.	.	H	α-helix	trans	-67.4	-43.4	174.4	0	0	0	0	0	111	H1693 K1699 A1700 I1701	H1693-A1697 WeakPolarHBondContact O-CA 3.48Å; H1693-A1697 WeakPolarHBondContact O-CB 3.46Å; H1693-A1697 PolarHBondContact O-N 3.46Å; A1697-K1699 VanDerWaalsContact C-N 3.33Å; A1697-K1699 PolarHBondContact O-N 3Å; A1697-A1700 CarbonylContact O-C 3.59Å; A1697-A1700 PolarHBondContact O-N 3.27Å; A1697-I1701 VanDerWaalsContact O-CB 3.26Å; A1697-I1701 WeakPolarHBondContact O-CB 2.84Å; A1697-I1701 WeakPolarHBondContact O-CD1 3.16Å; A1697-I1701 WeakPolarHBondContact O-CG1 3.34Å; A1697-I1701 PolarHBondContact O-N 2.82Å
1698	Y	78.4	Confident	67.5	Low	177 Å²	177	79 Å²	79	69%	0.694	42%	0.417	S	S	*	.	H	α-helix	trans	-63.5	-40.3	173.9	176.5	-99.4	0	0	0	111.2	F1694 G1702	F1694-Y1698 WeakPolarHBondContact O-CA 3.28Å; F1694-Y1698 WeakPolarHBondContact O-CB 3.29Å; F1694-Y1698 PolarHBondContact O-N 3.18Å; Y1698-G1702 PolarHBondContact O-N 3.33Å
1699	K	71.8	Confident	65.1	Low	96 Å²	96	79.4 Å²	79.4	42%	0.417	41%	0.412	S	S	.	.	H	α-helix	trans	-66	-38.7	174	-173.9	178.9	178.9	-176.3	0	110.9	Y1695 E1696 A1697 N1703	Y1695-K1699 HydrophobicContact CE1-CD 4.39Å; Y1695-K1699 WeakPolarHBondContact O-CB 3.25Å; Y1695-K1699 PolarHBondContact O-N 3.3Å; E1696-K1699 CarbonylContact O-C 3.45Å; E1696-K1699 PolarHBondContact O-N 2.96Å; A1697-K1699 VanDerWaalsContact C-N 3.33Å; A1697-K1699 PolarHBondContact O-N 3Å; K1699-N1703 VanDerWaalsContact O-CB 3.28Å; K1699-N1703 WeakPolarHBondContact O-CB 3.02Å; K1699-N1703 PolarHBondContact O-ND2 3.24Å
1700	A	65.6	Low	62.7	Low	16 Å²	16	81 Å²	81	13%	0.132	42%	0.42	C	S	.	.	H	α-helix	trans	-70	-45.3	176.8	0	0	0	0	0	111.6	S986 L987 E1696 A1697 G1702 N1703 Q1704	S986-A1700 VanDerWaalsContact OG-CA 3.24Å; S986-A1700 WeakPolarHBondContact OG-CA 3.45Å; S986-A1700 PolarHBondContact OG-O 3.02Å; L987-A1700 HydrophobicContact CD1-CB 4.37Å; E1696-A1700 WeakPolarHBondContact O-CB 3.13Å; E1696-A1700 PolarHBondContact O-N 3.35Å; A1697-A1700 CarbonylContact O-C 3.59Å; A1697-A1700 PolarHBondContact O-N 3.27Å; A1700-G1702 VanDerWaalsContact C-N 3.32Å; A1700-G1702 PolarHBondContact O-N 3.36Å; A1700-N1703 CarbonylContact O-C 3.59Å; A1700-N1703 WeakPolarHBondContact O-CA 3.34Å; A1700-N1703 WeakPolarHBondContact O-CB 2.98Å; A1700-N1703 PolarHBondContact O-N 3.43Å; A1700-Q1704 VanDerWaalsContact C-OE1 3.29Å; A1700-Q1704 WeakPolarHBondContact O-CA 3.16Å; A1700-Q1704 WeakPolarHBondContact O-CB 3.46Å; A1700-Q1704 PolarHBondContact O-N 3.01Å; A1700-Q1704 PolarHBondContact O-OE1 3.24Å
1701	I	72.9	Confident	60.5	Low	124 Å²	124	81.6 Å²	81.6	64%	0.636	43%	0.434	S	S	*	.	H	α-helix	trans	-63.8	-38.5	175.7	-67.7	163.6	0	0	0	110.7	A1697 N1703	A1697-I1701 VanDerWaalsContact O-CB 3.26Å; A1697-I1701 WeakPolarHBondContact O-CB 2.84Å; A1697-I1701 WeakPolarHBondContact O-CD1 3.16Å; A1697-I1701 WeakPolarHBondContact O-CG1 3.34Å; A1697-I1701 PolarHBondContact O-N 2.82Å; I1701-N1703 PolarHBondContact O-N 3.3Å
1702	G	63.3	Low	58	Low	50 Å²	50	80.8 Å²	80.8	52%	0.515	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-2.4	171.7	0	0	0	0	0	114.3	Y1698 A1700	Y1698-G1702 PolarHBondContact O-N 3.33Å; A1700-G1702 VanDerWaalsContact C-N 3.32Å; A1700-G1702 PolarHBondContact O-N 3.36Å
1703	N	57.9	Low	55.9	Low	29 Å²	29	80.3 Å²	80.3	16%	0.155	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.3	9.2	-164.5	-82.3	-65.3	0	0	0	114.4	Y984 T985 S986 K1699 A1700 I1701 C1705	Y984-N1703 WeakPolarHBondContact CB-OD1 2.78Å; T985-N1703 CarbonylContact C-O 3.57Å; T985-N1703 WeakPolarHBondContact CA-O 3.37Å; T985-N1703 WeakPolarHBondContact CA-OD1 3.47Å; T985-N1703 WeakPolarHBondContact CB-O 3.43Å; T985-N1703 PolarHBondContact N-OD1 2.94Å; T985-N1703 PolarHBondContact OG1-O 3.37Å; S986-N1703 PolarHBondContact N-O 2.99Å; S986-N1703 WeakPolarHBondContact OG-CB 3.22Å; S986-N1703 PolarHBondContact OG-O 3.37Å; K1699-N1703 VanDerWaalsContact O-CB 3.28Å; K1699-N1703 WeakPolarHBondContact O-CB 3.02Å; K1699-N1703 PolarHBondContact O-ND2 3.24Å; A1700-N1703 CarbonylContact O-C 3.59Å; A1700-N1703 WeakPolarHBondContact O-CA 3.34Å; A1700-N1703 WeakPolarHBondContact O-CB 2.98Å; A1700-N1703 PolarHBondContact O-N 3.43Å; I1701-N1703 PolarHBondContact O-N 3.3Å; N1703-C1705 VanDerWaalsContact C-N 3.27Å; N1703-C1705 PolarHBondContact O-N 3.35Å
1704	Q	51.9	Low	54.1	Low	100 Å²	100	82.4 Å²	82.4	47%	0.467	45%	0.45	S	S	.	.			trans	-66.8	-3.2	-146.8	-159	47.7	83.5	0	0	119.6	S986 A1700	S986-Q1704 CarbonylContact O-C 3.6Å; S986-Q1704 PolarHBondContact O-NE2 2.9Å; A1700-Q1704 VanDerWaalsContact C-OE1 3.29Å; A1700-Q1704 WeakPolarHBondContact O-CA 3.16Å; A1700-Q1704 WeakPolarHBondContact O-CB 3.46Å; A1700-Q1704 PolarHBondContact O-N 3.01Å; A1700-Q1704 PolarHBondContact O-OE1 3.24Å
1705	C	42.7	Very low	52.5	Low	114 Å²	114	82.2 Å²	82.2	77%	0.77	45%	0.449	S	S	*	.	S	Bend	trans	-70.8	-79.9	-168.3	-47.3	0	0	0	0	115.7	T985 N1703	T985-C1705 PolarHBondContact OG1-N 2.87Å; N1703-C1705 VanDerWaalsContact C-N 3.27Å; N1703-C1705 PolarHBondContact O-N 3.35Å
1706	A	38.8	Very low	51.2	Low	51 Å²	51	85.2 Å²	85.2	42%	0.421	46%	0.46	S	S	.	.			trans	-175	135.3	176.3	0	0	0	0	0	108	T985 L1708	T985-A1706 WeakPolarHBondContact CG2-O 3.48Å; T985-A1706 PolarHBondContact OG1-N 3.13Å; T985-A1706 PolarHBondContact OG1-O 3.46Å; T985-A1706 VanDerWaalsContact OG1-O 3.08Å; A1706-L1708 VanDerWaalsContact C-N 3.26Å; A1706-L1708 HydrophobicContact CB-CD1 3.76Å; A1706-L1708 WeakPolarHBondContact O-CD1 3.22Å; A1706-L1708 PolarHBondContact O-N 2.85Å
1707	S	37.6	Very low	51	Low	38 Å²	38	82.7 Å²	82.7	27%	0.266	45%	0.45	S	S	.	.			trans	-68.3	51.2	-162.7	-156.2	0	0	0	0	118.1	T985 L987 R1709 N1710 A1711	T985-S1707 WeakPolarHBondContact O-CA 3.35Å; T985-S1707 WeakPolarHBondContact O-CB 3.48Å; T985-S1707 PolarHBondContact O-OG 3.23Å; L987-S1707 WeakPolarHBondContact O-CB 3.24Å; S1707-R1709 PolarHBondContact O-N 3.37Å; S1707-R1709 VanDerWaalsContact O-N 3.14Å; S1707-N1710 VanDerWaalsContact OG-C 3.22Å; S1707-N1710 PolarHBondContact OG-O 3.15Å; S1707-A1711 PolarHBondContact OG-N 3.37Å
1708	L	36.6	Very low	51.1	Low	144 Å²	144	82.3 Å²	82.3	75%	0.754	44%	0.444	S	S	*	.	S	Bend	trans	-80.6	20.9	-176.6	-81.2	71	0	0	0	114.3	A1706	A1706-L1708 VanDerWaalsContact C-N 3.26Å; A1706-L1708 HydrophobicContact CB-CD1 3.76Å; A1706-L1708 WeakPolarHBondContact O-CD1 3.22Å; A1706-L1708 PolarHBondContact O-N 2.85Å
1709	R	32.1	Very low	51.3	Low	116 Å²	116	74.1 Å²	74.1	44%	0.438	41%	0.411	S	S	.	.	S	Bend	trans	-148.6	-42.7	174.5	-149.7	-158.8	74.7	-174.2	2.7	115.5	R981 G982 P983 Y984 S1707	R981-R1709 PolarHBondContact O-NH1 2.96Å; G982-R1709 VanDerWaalsContact CA-NH1 3.27Å; P983-R1709 WeakPolarHBondContact O-CD 3.22Å; P983-R1709 PolarHBondContact O-NH1 3.5Å; Y984-R1709 VanDerWaalsContact CG-NH2 3.28Å; Y984-R1709 VanDerWaalsContact CZ-NH2 3.26Å; Y984-R1709 VanDerWaalsContact N-CZ 3.34Å; S1707-R1709 PolarHBondContact O-N 3.37Å; S1707-R1709 VanDerWaalsContact O-N 3.14Å
1710	N	31.6	Very low	51.8	Low	34 Å²	34	70.8 Å²	70.8	18%	0.182	40%	0.4	C	S	.	.			trans	-139.2	90.5	174.5	-67	85.5	0	0	0	107.9	Y984 S1707 E1712	Y984-N1710 HydrophobicContact CD1-CB 3.73Å; Y984-N1710 WeakPolarHBondContact CD1-OD1 3.4Å; Y984-N1710 HydrophobicContact CE1-CB 4.49Å; Y984-N1710 HydrophobicContact CG-CB 4.48Å; Y984-N1710 PolarHBondContact O-N 3.18Å; S1707-N1710 VanDerWaalsContact OG-C 3.22Å; S1707-N1710 PolarHBondContact OG-O 3.15Å; N1710-E1712 HydrophobicContact CB-CB 4.12Å; N1710-E1712 HydrophobicContact CB-CG 4Å; N1710-E1712 PolarHBondContact O-N 2.9Å; N1710-E1712 VanDerWaalsContact O-N 3.16Å
1711	A	35	Very low	52.4	Low	71 Å²	71	72.7 Å²	72.7	59%	0.587	41%	0.41	S	S	*	.				49.1	0.4	57.2	0	0	0	0	0	115	S1707	S1707-A1711 PolarHBondContact OG-N 3.37Å
1712	E	33	Very low	52.6	Low	72 Å²	72	73.6 Å²	73.6	34%	0.336	41%	0.405	S	S	.	.			trans	-99.3	-18	-179.3	-87.1	176.4	162.7	0	0	114	Y984 N1710 K1715 Y1716	Y984-E1712 WeakPolarHBondContact CE1-OE2 3.35Å; N1710-E1712 HydrophobicContact CB-CB 4.12Å; N1710-E1712 HydrophobicContact CB-CG 4Å; N1710-E1712 PolarHBondContact O-N 2.9Å; N1710-E1712 VanDerWaalsContact O-N 3.16Å; E1712-K1715 HydrophobicContact CG-CD 4.41Å; E1712-K1715 VanDerWaalsContact O-CB 3.26Å; E1712-K1715 WeakPolarHBondContact O-CB 3.26Å; E1712-K1715 PolarHBondContact O-N 3.4Å; E1712-Y1716 WeakPolarHBondContact O-CD2 3.28Å; E1712-Y1716 VanDerWaalsContact O-CE2 3.3Å; E1712-Y1716 WeakPolarHBondContact O-CE2 3.3Å
1713	T	36.8	Very low	53.1	Low	49 Å²	49	72.7 Å²	72.7	30%	0.301	39%	0.387	S	S	.	.	S	Bend	trans	-77.2	-24	175.8	33.7	0	0	0	0	113.6	G988 K1715	G988-T1713 WeakPolarHBondContact O-CB 3.28Å; G988-T1713 PolarHBondContact O-OG1 3.36Å; T1713-K1715 VanDerWaalsContact C-N 3.27Å; T1713-K1715 PolarHBondContact O-N 3.22Å
1714	A	40.6	Very low	53.7	Low	68 Å²	68	74.8 Å²	74.8	56%	0.562	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-76.4	-13.1	170	0	0	0	0	0	113.3	Y1716	A1714-Y1716 PolarHBondContact O-N 3.15Å; A1714-Y1716 VanDerWaalsContact O-N 3.12Å
1715	K	47.3	Very low	54.9	Low	138 Å²	138	71.6 Å²	71.6	60%	0.6	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-73.6	-4.1	-171.3	-146.9	176	-173.4	178.9	0	114.2	E1712 T1713	E1712-K1715 HydrophobicContact CG-CD 4.41Å; E1712-K1715 VanDerWaalsContact O-CB 3.26Å; E1712-K1715 WeakPolarHBondContact O-CB 3.26Å; E1712-K1715 PolarHBondContact O-N 3.4Å; T1713-K1715 VanDerWaalsContact C-N 3.27Å; T1713-K1715 PolarHBondContact O-N 3.22Å
1716	Y	55.2	Low	56.7	Low	177 Å²	177	69.7 Å²	69.7	69%	0.694	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-124.4	18.3	-171.2	-59.5	-76	0	0	0	113.3	E1712 A1714 P1718	E1712-Y1716 WeakPolarHBondContact O-CD2 3.28Å; E1712-Y1716 VanDerWaalsContact O-CE2 3.3Å; E1712-Y1716 WeakPolarHBondContact O-CE2 3.3Å; A1714-Y1716 PolarHBondContact O-N 3.15Å; A1714-Y1716 VanDerWaalsContact O-N 3.12Å; Y1716-P1718 WeakPolarHBondContact O-CD 3.42Å
1717	N	69.5	Low	58.9	Low	30 Å²	30	73.5 Å²	73.5	16%	0.16	38%	0.379	C	S	.	.			trans	-85.4	115.7	169.2	-170.5	2	0	0	0	110.2	F1719	N1717-F1719 VanDerWaalsContact C-N 3.3Å; N1717-F1719 PolarHBondContact OD1-N 3.45Å; N1717-F1719 VanDerWaalsContact OD1-N 3.08Å
1718	P	75.4	Confident	60.9	Low	35 Å²	35	76.1 Å²	76.1	23%	0.227	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-25	175.7	28.9	-33.8	0	0	0	112.8	N1246 F1278 T1282 V1679 Y1716	N1246-P1718 PolarHBondContact ND2-O 3Å; F1278-P1718 WeakPolarHBondContact CZ-O 3.38Å; T1282-P1718 HydrophobicContact CG2-CB 3.69Å; T1282-P1718 HydrophobicContact CG2-CG 3.61Å; V1679-P1718 HydrophobicContact CB-CG 4.48Å; V1679-P1718 VanDerWaalsContact CG1-CD 3.44Å; V1679-P1718 HydrophobicContact CG1-CG 3.5Å; V1679-P1718 VanDerWaalsContact CG1-CG 3.5Å; V1679-P1718 HydrophobicContact CG2-CG 4.13Å; Y1716-P1718 WeakPolarHBondContact O-CD 3.42Å
1719	F	82	Confident	63.1	Low	4 Å²	4	70.8 Å²	70.8	2%	0.018	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-14.1	-176.8	-65.9	-72.5	0	0	0	114.3	S1256 I1258 F1278 L1279 T1282 Y1672 I1675 N1676 V1679 N1717	S1256-F1719 WeakPolarHBondContact CB-O 3.48Å; S1256-F1719 PolarHBondContact OG-O 3.41Å; I1258-F1719 HydrophobicContact CD1-CD1 4.35Å; I1258-F1719 HydrophobicContact CD1-CE1 4.44Å; I1258-F1719 HydrophobicContact CG2-CD1 4.25Å; F1278-F1719 AromaticContact CE1-CD1 3.97Å; F1278-F1719 HydrophobicContact CE1-CD1 3.97Å; F1278-F1719 HydrophobicContact CE1-CE1 4.16Å; L1279-F1719 HydrophobicContact CD2-CE1 3.72Å; L1279-F1719 HydrophobicContact CD2-CZ 4.21Å; T1282-F1719 HydrophobicContact CG2-CE2 4.43Å; T1282-F1719 HydrophobicContact CG2-CZ 4.17Å; Y1672-F1719 AromaticContact CD2-CE1 4Å; Y1672-F1719 HydrophobicContact CD2-CE1 4Å; Y1672-F1719 AromaticContact CE2-CD1 3.82Å; Y1672-F1719 HydrophobicContact CE2-CD1 3.82Å; Y1672-F1719 AromaticContact CE2-CE1 3.63Å; Y1672-F1719 HydrophobicContact CE2-CE1 3.63Å; Y1672-F1719 HydrophobicContact CE2-CZ 4.35Å; I1675-F1719 HydrophobicContact CB-CZ 4.48Å; I1675-F1719 HydrophobicContact CG2-CZ 3.85Å; N1676-F1719 HydrophobicContact CB-CE2 4.06Å; N1676-F1719 HydrophobicContact CB-CZ 4.26Å; V1679-F1719 HydrophobicContact CB-CE2 4.27Å; V1679-F1719 HydrophobicContact CG1-CE2 4.42Å; V1679-F1719 HydrophobicContact CG2-CE2 4.02Å; N1717-F1719 VanDerWaalsContact C-N 3.3Å; N1717-F1719 PolarHBondContact OD1-N 3.45Å; N1717-F1719 VanDerWaalsContact OD1-N 3.08Å
1720	C	82.2	Confident	65.7	Low	27 Å²	27	74.1 Å²	74.1	18%	0.182	37%	0.369	C	S	.	.	S	Bend	trans	-146	98.7	-179.6	-169.1	0	0	0	0	108.9	N1246	N1246-C1720 CarbonylContact O-C 3.54Å; N1246-C1720 VanDerWaalsContact O-CA 3.25Å; N1246-C1720 WeakPolarHBondContact O-CA 3.49Å
1721	V	78.7	Confident	68.4	Low	55 Å²	55	76.7 Å²	76.7	33%	0.333	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-108.8	126.3	-177.4	-178.6	0	0	0	0	108.9	N1246 H1247 E1248	N1246-V1721 PolarHBondContact O-N 2.96Å; H1247-V1721 WeakPolarHBondContact CA-O 3.22Å; E1248-V1721 PolarHBondContact N-O 3.26Å
1722	R	76	Confident	70.8	Confident	144 Å²	144	74 Å²	74	54%	0.543	36%	0.356	S	S	.	.			trans	-88.7	128.5	173.7	-170.5	173.8	177.8	175.5	4.3	110.3	T1724	R1722-T1724 PolarHBondContact O-N 3.38Å
1723	F	73.7	Confident	73.4	Confident	30 Å²	30	71.6 Å²	71.6	13%	0.132	35%	0.346	C	S	.	.			trans	-66.8	127.2	171.8	-69.2	-53	0	0	0	110.5	L1243 H1247 D1725 E1729 M1732	L1243-F1723 HydrophobicContact CB-CZ 4.42Å; L1243-F1723 HydrophobicContact CD2-CE1 4.18Å; H1247-F1723 HydrophobicContact CB-CE2 3.72Å; H1247-F1723 HydrophobicContact CB-CZ 4.05Å; H1247-F1723 AromaticContact CD2-CD2 3Å; H1247-F1723 WeakPolarHBondContact CD2-CD2 3.37Å; H1247-F1723 AromaticContact CD2-CE2 3Å; H1247-F1723 WeakPolarHBondContact CD2-CE2 3.34Å; H1247-F1723 AromaticContact CD2-CG 3.9Å; H1247-F1723 AromaticContact CD2-CZ 3.89Å; H1247-F1723 AromaticContact CE1-CD2 3.95Å; H1247-F1723 AromaticContact CG-CD2 3.76Å; H1247-F1723 AromaticContact CG-CE2 3.27Å; H1247-F1723 AromaticContact ND1-CE2 3.94Å; H1247-F1723 AromaticContact NE2-CD2 3.15Å; H1247-F1723 WeakPolarHBondContact NE2-CD2 3.48Å; H1247-F1723 AromaticContact NE2-CE2 3.56Å; F1723-D1725 VanDerWaalsContact C-N 3.31Å; F1723-E1729 HydrophobicContact CB-CB 4.07Å; F1723-E1729 HydrophobicContact CD2-CB 3.77Å; F1723-E1729 HydrophobicContact CD2-CG 3.93Å; F1723-E1729 HydrophobicContact CG-CB 4.24Å; F1723-M1732 HydrophobicContact CD1-CE 3.64Å; F1723-M1732 HydrophobicContact CD2-CE 3.66Å; F1723-M1732 HydrophobicContact CE1-CE 3.28Å; F1723-M1732 HydrophobicContact CE1-SD 3.83Å; F1723-M1732 HydrophobicContact CE2-CE 3.27Å; F1723-M1732 HydrophobicContact CE2-SD 3.82Å; F1723-M1732 HydrophobicContact CG-CE 3.88Å; F1723-M1732 HydrophobicContact CZ-CE 3.1Å; F1723-M1732 HydrophobicContact CZ-SD 3.32Å; F1723-M1732 WeakPolarHBondContact CZ-SD 3.34Å
1724	T	70.6	Confident	76	Confident	74 Å²	74	76.7 Å²	76.7	45%	0.454	36%	0.364	S	S	.	.	S	Bend	trans	-78.4	-23.1	172.5	55.3	0	0	0	0	111.6	S925 T927 R1722	S925-T1724 WeakPolarHBondContact CA-O 3.32Å; S925-T1724 VanDerWaalsContact CB-O 3.27Å; S925-T1724 WeakPolarHBondContact CB-O 3.39Å; T927-T1724 WeakPolarHBondContact CG2-O 3.37Å; T927-T1724 PolarHBondContact N-OG1 2.91Å; R1722-T1724 PolarHBondContact O-N 3.38Å
1725	D	77.9	Confident	78.4	Confident	32 Å²	32	74.7 Å²	74.7	17%	0.171	34%	0.342	C	S	.	.			trans	-109.3	105.3	-178.8	-170.2	-8.4	0	0	0	110.7	T927 F1723 K1727 K1728 E1729	T927-D1725 HydrophobicContact CG2-CB 3.77Å; F1723-D1725 VanDerWaalsContact C-N 3.31Å; D1725-K1727 PolarHBondContact O-N 3.39Å; D1725-K1727 VanDerWaalsContact OD1-CB 3.24Å; D1725-K1727 WeakPolarHBondContact OD1-CB 3.19Å; D1725-K1727 PolarHBondContact OD1-N 3.09Å; D1725-K1728 HydrophobicContact CB-CB 4.11Å; D1725-K1728 HydrophobicContact CB-CD 4.08Å; D1725-K1728 HydrophobicContact CB-CG 4.01Å; D1725-K1728 PolarHBondContact O-N 3.45Å; D1725-K1728 VanDerWaalsContact O-N 3.12Å; D1725-E1729 PolarHBondContact O-N 2.91Å; D1725-E1729 VanDerWaalsContact O-N 3.09Å
1726	V	79.8	Confident	80.5	Confident	74 Å²	74	68.4 Å²	68.4	45%	0.448	32%	0.315	S	S	.	.	H	α-helix	trans	-60.4	-26.8	178.3	-177.9	0	0	0	0	111.4	R1730	V1726-R1730 PolarHBondContact O-N 3.34Å; V1726-R1730 VanDerWaalsContact O-N 3.09Å
1727	K	84.7	Confident	82.2	Confident	132 Å²	132	62.7 Å²	62.7	57%	0.574	29%	0.294	S	S	*	.	H	α-helix	trans	-68	-45.4	176.3	-172.3	175.4	-177.7	-77.4	0	110.7	D1725 R1730 E1731	D1725-K1727 PolarHBondContact O-N 3.39Å; D1725-K1727 VanDerWaalsContact OD1-CB 3.24Å; D1725-K1727 WeakPolarHBondContact OD1-CB 3.19Å; D1725-K1727 PolarHBondContact OD1-N 3.09Å; K1727-R1730 PolarHBondContact O-N 2.89Å; K1727-E1731 IonicContact NZ-OE1 3.76Å; K1727-E1731 PolarHBondContact NZ-OE1 2.83Å; K1727-E1731 WeakPolarHBondContact O-CG 3.4Å; K1727-E1731 PolarHBondContact O-N 3.31Å
1728	K	81.1	Confident	83.2	Confident	92 Å²	92	65.7 Å²	65.7	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-43.3	175.9	-69.9	-175.2	-178.4	-171.4	0	111.7	D1725 R1730 E1731 M1732	D1725-K1728 HydrophobicContact CB-CB 4.11Å; D1725-K1728 HydrophobicContact CB-CD 4.08Å; D1725-K1728 HydrophobicContact CB-CG 4.01Å; D1725-K1728 PolarHBondContact O-N 3.45Å; D1725-K1728 VanDerWaalsContact O-N 3.12Å; K1728-R1730 VanDerWaalsContact C-N 3.34Å; K1728-R1730 PolarHBondContact O-N 3.42Å; K1728-E1731 PolarHBondContact O-N 3.31Å; K1728-E1731 VanDerWaalsContact O-N 3.17Å; K1728-M1732 VanDerWaalsContact C-CE 3.43Å; K1728-M1732 HydrophobicContact CB-CE 3.93Å; K1728-M1732 WeakPolarHBondContact O-CE 3.35Å; K1728-M1732 PolarHBondContact O-N 2.87Å
1729	E	82.9	Confident	84	Confident	33 Å²	33	64.6 Å²	64.6	15%	0.154	30%	0.3	C	S	.	.	H	α-helix	trans	-54.9	-48.9	174.6	-177.2	-179.7	175.4	0	0	111.2	H1247 F1723 D1725 E1731 M1732 V1733	H1247-E1729 IonicContact CE1-OE1 2.9Å; H1247-E1729 IonicContact NE2-OE1 2.73Å; F1723-E1729 HydrophobicContact CB-CB 4.07Å; F1723-E1729 HydrophobicContact CD2-CB 3.77Å; F1723-E1729 HydrophobicContact CD2-CG 3.93Å; F1723-E1729 HydrophobicContact CG-CB 4.24Å; D1725-E1729 PolarHBondContact O-N 2.91Å; D1725-E1729 VanDerWaalsContact O-N 3.09Å; E1729-E1731 PolarHBondContact O-N 3.25Å; E1729-M1732 PolarHBondContact O-N 3.21Å; E1729-V1733 WeakPolarHBondContact O-CG2 3.43Å; E1729-V1733 PolarHBondContact O-N 3.29Å
1730	R	85.6	Confident	84.3	Confident	185 Å²	185	64.5 Å²	64.5	70%	0.698	30%	0.3	S	S	*	.	H	α-helix	trans	-61.9	-40.8	175.7	-75.8	-174.7	-160.3	-174.4	3.5	113.2	V1726 K1727 K1728 M1732 K1734	V1726-R1730 PolarHBondContact O-N 3.34Å; V1726-R1730 VanDerWaalsContact O-N 3.09Å; K1727-R1730 PolarHBondContact O-N 2.89Å; K1728-R1730 VanDerWaalsContact C-N 3.34Å; K1728-R1730 PolarHBondContact O-N 3.42Å; R1730-M1732 VanDerWaalsContact C-N 3.32Å; R1730-K1734 WeakPolarHBondContact O-CB 3.24Å; R1730-K1734 PolarHBondContact O-N 3.18Å
1731	E	87.8	Confident	84.6	Confident	88 Å²	88	65.8 Å²	65.8	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-36.8	177.7	-73.9	169.4	-172.8	0	0	111.5	R1240 K1727 K1728 E1729 W1735	R1240-E1731 PolarHBondContact NH2-O 3.38Å; K1727-E1731 IonicContact NZ-OE1 3.76Å; K1727-E1731 PolarHBondContact NZ-OE1 2.83Å; K1727-E1731 WeakPolarHBondContact O-CG 3.4Å; K1727-E1731 PolarHBondContact O-N 3.31Å; K1728-E1731 PolarHBondContact O-N 3.31Å; K1728-E1731 VanDerWaalsContact O-N 3.17Å; E1729-E1731 PolarHBondContact O-N 3.25Å; E1731-W1735 WeakPolarHBondContact O-CB 3.26Å; E1731-W1735 PolarHBondContact O-N 2.95Å; E1731-W1735 VanDerWaalsContact O-N 3.12Å
1732	M	85.8	Confident	85	Confident	15 Å²	15	65.4 Å²	65.4	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-70.9	-48.9	175.4	-79.8	175.7	-74.5	0	0	112.4	R1240 L1243 F1723 K1728 E1729 R1730 K1734 W1735 E1736	R1240-M1732 HydrophobicContact CG-CG 4.37Å; L1243-M1732 HydrophobicContact CB-SD 4.17Å; L1243-M1732 HydrophobicContact CD2-SD 4.21Å; F1723-M1732 HydrophobicContact CD1-CE 3.64Å; F1723-M1732 HydrophobicContact CD2-CE 3.66Å; F1723-M1732 HydrophobicContact CE1-CE 3.28Å; F1723-M1732 HydrophobicContact CE1-SD 3.83Å; F1723-M1732 HydrophobicContact CE2-CE 3.27Å; F1723-M1732 HydrophobicContact CE2-SD 3.82Å; F1723-M1732 HydrophobicContact CG-CE 3.88Å; F1723-M1732 HydrophobicContact CZ-CE 3.1Å; F1723-M1732 HydrophobicContact CZ-SD 3.32Å; F1723-M1732 WeakPolarHBondContact CZ-SD 3.34Å; K1728-M1732 VanDerWaalsContact C-CE 3.43Å; K1728-M1732 HydrophobicContact CB-CE 3.93Å; K1728-M1732 WeakPolarHBondContact O-CE 3.35Å; K1728-M1732 PolarHBondContact O-N 2.87Å; E1729-M1732 PolarHBondContact O-N 3.21Å; R1730-M1732 VanDerWaalsContact C-N 3.32Å; M1732-K1734 VanDerWaalsContact C-N 3.3Å; M1732-K1734 PolarHBondContact O-N 3.19Å; M1732-W1735 PolarHBondContact O-N 3.4Å; M1732-E1736 PolarHBondContact O-N 3.41Å
1733	V	87.8	Confident	85.5	Confident	21 Å²	21	61.2 Å²	61.2	13%	0.127	28%	0.284	C	S	.	.	H	α-helix	trans	-59.6	-42.5	176.6	172.9	0	0	0	0	110.9	K1186 E1187 E1729 W1735 E1736 H1737	K1186-V1733 HydrophobicContact CB-CG1 4.03Å; K1186-V1733 WeakPolarHBondContact O-CG1 3.36Å; E1187-V1733 HydrophobicContact CG-CG1 3.98Å; E1187-V1733 HydrophobicContact CG-CG2 4.13Å; E1729-V1733 WeakPolarHBondContact O-CG2 3.43Å; E1729-V1733 PolarHBondContact O-N 3.29Å; V1733-W1735 VanDerWaalsContact C-N 3.29Å; V1733-W1735 PolarHBondContact O-N 3.24Å; V1733-E1736 PolarHBondContact O-N 3.41Å; V1733-H1737 WeakPolarHBondContact O-CB 3.37Å; V1733-H1737 PolarHBondContact O-N 3.29Å
1734	K	90.8	Very high	86	Confident	157 Å²	157	62.7 Å²	62.7	68%	0.683	29%	0.294	S	S	*	.	H	α-helix	trans	-61.6	-37.8	175.4	-175.8	179	178.5	-176.1	0	112.2	R1730 M1732 M1738	R1730-K1734 WeakPolarHBondContact O-CB 3.24Å; R1730-K1734 PolarHBondContact O-N 3.18Å; M1732-K1734 VanDerWaalsContact C-N 3.3Å; M1732-K1734 PolarHBondContact O-N 3.19Å; K1734-M1738 WeakPolarHBondContact O-CB 3.4Å; K1734-M1738 PolarHBondContact O-N 3.41Å
1735	W	91.8	Very high	86.3	Confident	26 Å²	26	67.4 Å²	67.4	10%	0.098	30%	0.303	C	S	.	.	H	α-helix	trans	-73.1	-41.7	178.8	178.2	80.6	0	0	0	112.4	C1233 E1236 D1237 R1240 I1244 E1731 M1732 V1733 H1737 M1738 K1739	C1233-W1735 HydrophobicContact CB-CH2 4.12Å; C1233-W1735 HydrophobicContact CB-CZ3 4.2Å; E1236-W1735 HydrophobicContact CB-CZ2 4.2Å; D1237-W1735 HydrophobicContact CB-CH2 3.97Å; D1237-W1735 HydrophobicContact CB-CZ2 3.81Å; R1240-W1735 HydrophobicContact CB-CH2 4.03Å; R1240-W1735 HydrophobicContact CB-CZ3 4.02Å; R1240-W1735 VanDerWaalsContact CD-CE3 3.47Å; R1240-W1735 HydrophobicContact CG-CD2 4.34Å; R1240-W1735 HydrophobicContact CG-CE3 3.79Å; R1240-W1735 HydrophobicContact CG-CH2 4.06Å; R1240-W1735 HydrophobicContact CG-CZ3 3.62Å; I1244-W1735 HydrophobicContact CD1-CE3 3.55Å; I1244-W1735 HydrophobicContact CD1-CZ3 3.43Å; I1244-W1735 VanDerWaalsContact CD1-CZ3 3.43Å; E1731-W1735 WeakPolarHBondContact O-CB 3.26Å; E1731-W1735 PolarHBondContact O-N 2.95Å; E1731-W1735 VanDerWaalsContact O-N 3.12Å; M1732-W1735 PolarHBondContact O-N 3.4Å; V1733-W1735 VanDerWaalsContact C-N 3.29Å; V1733-W1735 PolarHBondContact O-N 3.24Å; W1735-H1737 VanDerWaalsContact C-N 3.32Å; W1735-H1737 PolarHBondContact O-N 2.87Å; W1735-M1738 PolarHBondContact O-N 2.88Å; W1735-K1739 HydrophobicContact CD2-CG 4.32Å; W1735-K1739 HydrophobicContact CZ2-CG 4.34Å; W1735-K1739 WeakPolarHBondContact O-CG 3.43Å; W1735-K1739 PolarHBondContact O-N 3.32Å
1736	E	92.1	Very high	85.6	Confident	5 Å²	5	67.9 Å²	67.9	2%	0.023	30%	0.304	C	S	.	.	H	α-helix	trans	-55.2	-49.2	171.4	-172.9	-170.8	161.5	0	0	110.7	P1188 I1189 I1244 M1732 V1733 M1738 K1739 A1740	P1188-E1736 WeakPolarHBondContact CD-OE1 3.39Å; P1188-E1736 HydrophobicContact CG-CG 4.3Å; I1189-E1736 WeakPolarHBondContact CB-OE1 3.28Å; I1189-E1736 HydrophobicContact CD1-CG 4.17Å; I1189-E1736 HydrophobicContact CG1-CG 4.42Å; I1189-E1736 WeakPolarHBondContact CG1-OE1 3.41Å; I1189-E1736 PolarHBondContact N-OE1 3.37Å; I1244-E1736 HydrophobicContact CD1-CB 4.18Å; M1732-E1736 PolarHBondContact O-N 3.41Å; V1733-E1736 PolarHBondContact O-N 3.41Å; E1736-M1738 PolarHBondContact O-N 2.89Å; E1736-K1739 PolarHBondContact O-N 3.48Å; E1736-A1740 PolarHBondContact O-N 3.17Å
1737	H	90.6	Very high	84.3	Confident	58 Å²	58	68.2 Å²	68.2	27%	0.269	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-42.7	178.4	-176.1	75.2	0	0	0	112.4	E1185 V1733 W1735 K1739 A1740 M1741	E1185-H1737 PolarHBondContact O-CE1 3.23Å; E1185-H1737 PolarHBondContact O-ND1 3.36Å; V1733-H1737 WeakPolarHBondContact O-CB 3.37Å; V1733-H1737 PolarHBondContact O-N 3.29Å; W1735-H1737 VanDerWaalsContact C-N 3.32Å; W1735-H1737 PolarHBondContact O-N 2.87Å; H1737-K1739 VanDerWaalsContact C-N 3.34Å; H1737-K1739 PolarHBondContact O-N 2.69Å; H1737-A1740 PolarHBondContact O-N 3.15Å; H1737-M1741 WeakPolarHBondContact O-CG 3.29Å; H1737-M1741 PolarHBondContact O-N 2.78Å
1738	M	90.6	Very high	82.2	Confident	92 Å²	92	66.3 Å²	66.3	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-42.3	175.6	-174.1	178.5	74.4	0	0	111.7	K1734 W1735 E1736 M1741 D1742	K1734-M1738 WeakPolarHBondContact O-CB 3.4Å; K1734-M1738 PolarHBondContact O-N 3.41Å; W1735-M1738 PolarHBondContact O-N 2.88Å; E1736-M1738 PolarHBondContact O-N 2.89Å; M1738-M1741 WeakPolarHBondContact O-CB 3.3Å; M1738-M1741 PolarHBondContact O-N 2.8Å; M1738-D1742 PolarHBondContact O-N 3.07Å
1739	K	90.7	Very high	80.4	Confident	13 Å²	13	66.2 Å²	66.2	6%	0.057	32%	0.318	C	S	.	.	H	α-helix	trans	-69.6	-33.7	177.9	-69.8	-71.1	156.2	-152.6	0	112.9	E1232 E1236 W1735 E1736 H1737 M1741 D1742 Y1743	E1232-K1739 HydrophobicContact CG-CD 4.39Å; E1236-K1739 HydrophobicContact CB-CD 4.4Å; E1236-K1739 VanDerWaalsContact CD-NZ 3.26Å; E1236-K1739 HydrophobicContact CG-CD 3.93Å; E1236-K1739 IonicContact OE1-NZ 3.38Å; E1236-K1739 PolarHBondContact OE1-NZ 3.35Å; E1236-K1739 IonicContact OE2-NZ 2.66Å; W1735-K1739 HydrophobicContact CD2-CG 4.32Å; W1735-K1739 HydrophobicContact CZ2-CG 4.34Å; W1735-K1739 WeakPolarHBondContact O-CG 3.43Å; W1735-K1739 PolarHBondContact O-N 3.32Å; E1736-K1739 PolarHBondContact O-N 3.48Å; H1737-K1739 VanDerWaalsContact C-N 3.34Å; H1737-K1739 PolarHBondContact O-N 2.69Å; K1739-M1741 VanDerWaalsContact C-N 3.33Å; K1739-D1742 IonicContact NZ-OD2 3.15Å; K1739-D1742 PolarHBondContact NZ-OD2 2.78Å; K1739-D1742 PolarHBondContact O-N 2.67Å; K1739-Y1743 PolarHBondContact O-N 3.31Å
1740	A	89.9	Confident	78.3	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-65.1	-36.4	169.9	0	0	0	0	0	112.6	P1188 V1229 E1736 H1737 Y1743 L1744	P1188-A1740 HydrophobicContact CB-CB 4.06Å; P1188-A1740 HydrophobicContact CG-CB 3.38Å; V1229-A1740 HydrophobicContact CG1-CB 3.76Å; V1229-A1740 HydrophobicContact CG2-CB 3.92Å; E1736-A1740 PolarHBondContact O-N 3.17Å; H1737-A1740 PolarHBondContact O-N 3.15Å; A1740-Y1743 PolarHBondContact O-N 2.7Å; A1740-L1744 WeakPolarHBondContact O-CG 3.27Å; A1740-L1744 PolarHBondContact O-N 2.77Å
1741	M	88.1	Confident	75.9	Confident	55 Å²	55	64.8 Å²	64.8	27%	0.271	33%	0.331	S	S	.	.	H	α-helix	trans	-66.7	-37.5	172.5	-67.2	-62.1	102.1	0	0	112.1	T1183 H1737 M1738 K1739 L1744 R1745	T1183-M1741 WeakPolarHBondContact O-CE 3.27Å; H1737-M1741 WeakPolarHBondContact O-CG 3.29Å; H1737-M1741 PolarHBondContact O-N 2.78Å; M1738-M1741 WeakPolarHBondContact O-CB 3.3Å; M1738-M1741 PolarHBondContact O-N 2.8Å; K1739-M1741 VanDerWaalsContact C-N 3.33Å; M1741-L1744 HydrophobicContact CE-CD1 3.58Å; M1741-L1744 PolarHBondContact O-N 2.76Å; M1741-R1745 WeakPolarHBondContact O-CG 3.29Å; M1741-R1745 PolarHBondContact O-N 3.09Å; M1741-R1745 VanDerWaalsContact O-N 3.17Å
1742	D	87.1	Confident	73.5	Confident	46 Å²	46	66.8 Å²	66.8	25%	0.246	35%	0.35	C	S	.	.	H	α-helix	trans	-62.2	-46.5	172.5	-65.9	-21.7	0	0	0	110.5	M1738 K1739 L1744 R1745 E1746	M1738-D1742 PolarHBondContact O-N 3.07Å; K1739-D1742 IonicContact NZ-OD2 3.15Å; K1739-D1742 PolarHBondContact NZ-OD2 2.78Å; K1739-D1742 PolarHBondContact O-N 2.67Å; D1742-L1744 VanDerWaalsContact C-N 3.32Å; D1742-L1744 PolarHBondContact O-N 2.78Å; D1742-R1745 WeakPolarHBondContact O-CB 3.33Å; D1742-R1745 PolarHBondContact O-N 3.28Å; D1742-E1746 PolarHBondContact O-N 2.97Å
1743	Y	86.7	Confident	70.9	Confident	56 Å²	56	69.2 Å²	69.2	22%	0.22	38%	0.378	C	S	.	.	H	α-helix	trans	-57	-41.7	174.1	169.1	-102.2	0	0	0	112.5	V1229 K1739 A1740 R1745 E1746 P1747	V1229-Y1743 HydrophobicContact CG2-CD1 3.73Å; V1229-Y1743 HydrophobicContact CG2-CE1 4.3Å; V1229-Y1743 HydrophobicContact CG2-CG 4.18Å; K1739-Y1743 PolarHBondContact O-N 3.31Å; A1740-Y1743 PolarHBondContact O-N 2.7Å; Y1743-R1745 VanDerWaalsContact C-N 3.26Å; Y1743-R1745 PolarHBondContact O-N 3.29Å; Y1743-E1746 PolarHBondContact O-N 2.67Å; Y1743-P1747 WeakPolarHBondContact O-CD 3.13Å
1744	L	83.5	Confident	68.4	Low	62 Å²	62	73.4 Å²	73.4	33%	0.325	40%	0.395	S	S	.	.	H	α-helix	trans	-69.9	-19.7	177.2	-74.1	176.8	0	0	0	113.9	W1182 T1183 A1740 M1741 D1742	W1182-L1744 HydrophobicContact CZ3-CD1 4.5Å; W1182-L1744 HydrophobicContact CZ3-CD2 4.05Å; T1183-L1744 HydrophobicContact CG2-CD1 3.84Å; A1740-L1744 WeakPolarHBondContact O-CG 3.27Å; A1740-L1744 PolarHBondContact O-N 2.77Å; M1741-L1744 HydrophobicContact CE-CD1 3.58Å; M1741-L1744 PolarHBondContact O-N 2.76Å; D1742-L1744 VanDerWaalsContact C-N 3.32Å; D1742-L1744 PolarHBondContact O-N 2.78Å
1745	R	78	Confident	65.5	Low	173 Å²	173	77.9 Å²	77.9	65%	0.653	41%	0.407	S	S	*	.	H	α-helix	trans	-85.6	-22.9	174.4	-71.4	172.4	-179.2	179.5	-0.5	113.2	M1741 D1742 Y1743 S1748 T1749	M1741-R1745 WeakPolarHBondContact O-CG 3.29Å; M1741-R1745 PolarHBondContact O-N 3.09Å; M1741-R1745 VanDerWaalsContact O-N 3.17Å; D1742-R1745 WeakPolarHBondContact O-CB 3.33Å; D1742-R1745 PolarHBondContact O-N 3.28Å; Y1743-R1745 VanDerWaalsContact C-N 3.26Å; Y1743-R1745 PolarHBondContact O-N 3.29Å; R1745-S1748 PolarHBondContact O-N 3.49Å; R1745-S1748 PolarHBondContact O-OG 3.28Å; R1745-T1749 PolarHBondContact O-OG1 3.03Å
1746	E	62.3	Low	62.4	Low	42 Å²	42	79.5 Å²	79.5	20%	0.196	43%	0.432	C	S	.	.	H	α-helix	trans	-65.9	-35	-178.9	-71.9	-162.7	144.1	0	0	115.1	R1235 D1742 Y1743 S1748 T1749 K1750	R1235-E1746 IonicContact CZ-OE1 3.88Å; R1235-E1746 IonicContact NH1-OE1 2.78Å; R1235-E1746 IonicContact NH2-OE1 2.75Å; R1235-E1746 PolarHBondContact NH2-OE1 2.99Å; D1742-E1746 PolarHBondContact O-N 2.97Å; Y1743-E1746 PolarHBondContact O-N 2.67Å; E1746-S1748 VanDerWaalsContact C-N 3.26Å; E1746-S1748 PolarHBondContact O-N 3.32Å; E1746-T1749 PolarHBondContact O-N 2.95Å; E1746-T1749 VanDerWaalsContact O-N 3.11Å; E1746-T1749 PolarHBondContact O-OG1 2.87Å; E1746-T1749 VanDerWaalsContact O-OG1 3.12Å; E1746-K1750 HydrophobicContact CB-CD 4.42Å; E1746-K1750 PolarHBondContact O-N 2.71Å; E1746-K1750 IonicContact OE1-NZ 2.74Å; E1746-K1750 PolarHBondContact OE1-NZ 3.42Å; E1746-K1750 IonicContact OE2-NZ 3.18Å; E1746-K1750 PolarHBondContact OE2-NZ 3.13Å
1747	P	53.5	Low	59.4	Low	80 Å²	80	86.1 Å²	86.1	52%	0.519	47%	0.472	S	S	.	.	H	α-helix	trans	-59.7	-32.1	177.2	-25.7	31.4	0	0	0	113.9	Y1743 T1749 A1751	Y1743-P1747 WeakPolarHBondContact O-CD 3.13Å; P1747-T1749 VanDerWaalsContact C-N 3.3Å; P1747-T1749 PolarHBondContact O-N 3.16Å; P1747-A1751 WeakPolarHBondContact O-CB 3.38Å
1748	S	40.6	Very low	56.4	Low	92 Å²	92	87 Å²	87	64%	0.643	49%	0.49	S	S	*	.	H	α-helix	trans	-77.2	-16.1	178.8	63.4	0	0	0	0	113.5	R1745 E1746	R1745-S1748 PolarHBondContact O-N 3.49Å; R1745-S1748 PolarHBondContact O-OG 3.28Å; E1746-S1748 VanDerWaalsContact C-N 3.26Å; E1746-S1748 PolarHBondContact O-N 3.32Å
1749	T	42.6	Very low	53.6	Low	91 Å²	91	88.6 Å²	88.6	56%	0.558	50%	0.496	S	S	*	.	H	α-helix	trans	-111.2	-23.6	-175.4	53.6	0	0	0	0	113.8	R1745 E1746 P1747 T1752	R1745-T1749 PolarHBondContact O-OG1 3.03Å; E1746-T1749 PolarHBondContact O-N 2.95Å; E1746-T1749 VanDerWaalsContact O-N 3.11Å; E1746-T1749 PolarHBondContact O-OG1 2.87Å; E1746-T1749 VanDerWaalsContact O-OG1 3.12Å; P1747-T1749 VanDerWaalsContact C-N 3.3Å; P1747-T1749 PolarHBondContact O-N 3.16Å; T1749-T1752 PolarHBondContact O-OG1 3.43Å
1750	K	38	Very low	50.6	Low	110 Å²	110	93.3 Å²	93.3	48%	0.478	53%	0.531	S	S	.	.	H	α-helix	trans	-90.2	-17.6	175.4	-69.9	179.1	-177.2	167.6	0	113.7	E1746 T1752 G1753 K1754	E1746-K1750 HydrophobicContact CB-CD 4.42Å; E1746-K1750 PolarHBondContact O-N 2.71Å; E1746-K1750 IonicContact OE1-NZ 2.74Å; E1746-K1750 PolarHBondContact OE1-NZ 3.42Å; E1746-K1750 IonicContact OE2-NZ 3.18Å; E1746-K1750 PolarHBondContact OE2-NZ 3.13Å; K1750-T1752 PolarHBondContact O-N 3.28Å; K1750-G1753 PolarHBondContact O-N 3.13Å; K1750-K1754 PolarHBondContact O-N 3.45Å
1751	A	34.9	Very low	47.9	Very low	78 Å²	78	103.4 Å²	103.4	65%	0.645	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-23.2	173.4	0	0	0	0	0	112.9	P1747 G1753	P1747-A1751 WeakPolarHBondContact O-CB 3.38Å; A1751-G1753 VanDerWaalsContact C-N 3.31Å
1752	T	37.9	Very low	45.1	Very low	130 Å²	130	103.6 Å²	103.6	80%	0.798	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	5	175.1	45.6	0	0	0	0	113.6	T1749 K1750	T1749-T1752 PolarHBondContact O-OG1 3.43Å; K1750-T1752 PolarHBondContact O-N 3.28Å
1753	G	31.5	Very low	42.3	Very low	65 Å²	65	107 Å²	107	67%	0.67	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	3.1	176.8	0	0	0	0	0	116.4	K1750 A1751 R1755	K1750-G1753 PolarHBondContact O-N 3.13Å; A1751-G1753 VanDerWaalsContact C-N 3.31Å; G1753-R1755 PolarHBondContact O-N 2.99Å
1754	K	35.3	Very low	39.7	Very low	109 Å²	109	108.6 Å²	108.6	47%	0.474	62%	0.617	S	S	.	*			trans	-75.2	87.8	-172.4	-170.2	174.3	177.2	176	0	113.1	K1750 A1758 E1759	K1750-K1754 PolarHBondContact O-N 3.45Å; K1754-A1758 VanDerWaalsContact CE-O 3.27Å; K1754-A1758 WeakPolarHBondContact CE-O 2.94Å; K1754-A1758 PolarHBondContact NZ-O 3.44Å; K1754-E1759 VanDerWaalsContact NZ-CD 3.25Å; K1754-E1759 IonicContact NZ-OE1 2.69Å; K1754-E1759 IonicContact NZ-OE2 3.98Å; K1754-E1759 PolarHBondContact NZ-OE2 3.49Å
1755	R	29.1	Very low	37.2	Very low	252 Å²	252	112.6 Å²	112.6	95%	0.951	63%	0.632	S	S	*	*			trans	-125.1	95.5	156.2	-82.9	-171.6	177.8	178.2	0.2	111.8	G1753	G1753-R1755 PolarHBondContact O-N 2.99Å
1756	G	27.5	Very low	34.9	Very low	60 Å²	60	113.2 Å²	113.2	62%	0.619	63%	0.634	S	S	*	*	S	Bend	trans	168.1	77.7	171.9	0	0	0	0	0	111.5
1757	V	28.7	Very low	33.2	Very low	143 Å²	143	113.9 Å²	113.9	87%	0.867	65%	0.652	S	S	*	*	S	Bend	trans	76.5	130	160.6	-164.1	0	0	0	0	115.8
1758	A	27.7	Very low	32	Very low	78 Å²	78	113.9 Å²	113.9	65%	0.645	67%	0.666	S	S	*	*	S	Bend	trans	73.6	85.9	173.9	0	0	0	0	0	117.6	K1754	K1754-A1758 VanDerWaalsContact CE-O 3.27Å; K1754-A1758 WeakPolarHBondContact CE-O 2.94Å; K1754-A1758 PolarHBondContact NZ-O 3.44Å
1759	E	31.9	Very low	31.3	Very low	124 Å²	124	113.7 Å²	113.7	58%	0.579	68%	0.679	S	S	*	*			trans	171	71.5	138.6	-96.7	168.3	179.8	0	0	110.8	K1754 R1761 A1762	K1754-E1759 VanDerWaalsContact NZ-CD 3.25Å; K1754-E1759 IonicContact NZ-OE1 2.69Å; K1754-E1759 IonicContact NZ-OE2 3.98Å; K1754-E1759 PolarHBondContact NZ-OE2 3.49Å; E1759-R1761 PolarHBondContact O-N 3.41Å; E1759-A1762 HydrophobicContact CB-CB 3.94Å; E1759-A1762 HydrophobicContact CG-CB 4.45Å; E1759-A1762 PolarHBondContact O-N 3.12Å
1760	S	27.9	Very low	30.7	Very low	112 Å²	112	113 Å²	113	78%	0.783	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	17.2	174.5	-55.9	0	0	0	0	114.2
1761	R	32	Very low	30.3	Very low	214 Å²	214	115.4 Å²	115.4	81%	0.808	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	-2.7	170.4	-96.2	179.8	166.5	159.1	-4.2	114	E1759 F1765	E1759-R1761 PolarHBondContact O-N 3.41Å; R1761-F1765 VanDerWaalsContact O-CD2 3.25Å; R1761-F1765 WeakPolarHBondContact O-CD2 3.31Å
1762	A	30.7	Very low	29.9	Very low	58 Å²	58	115 Å²	115	48%	0.479	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	-58.9	174	0	0	0	0	0	111.6	E1759	E1759-A1762 HydrophobicContact CB-CB 3.94Å; E1759-A1762 HydrophobicContact CG-CB 4.45Å; E1759-A1762 PolarHBondContact O-N 3.12Å
1763	V	28.8	Very low	29.4	Very low	118 Å²	118	115.6 Å²	115.6	72%	0.715	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-71.9	-35.5	-175.1	-175	0	0	0	0	112.2	F1765 R1766	V1763-F1765 PolarHBondContact O-N 2.96Å; V1763-R1766 PolarHBondContact O-N 3.39Å
1764	V	30.7	Very low	29.2	Very low	90 Å²	90	116 Å²	116	55%	0.545	73%	0.728	S	S	.	*	G	3₁₀ helix	trans	-74.9	-8.9	-171.3	-174	0	0	0	0	113	R1766 G1767	V1764-R1766 PolarHBondContact O-N 2.62Å; V1764-R1766 VanDerWaalsContact O-N 3.08Å; V1764-G1767 PolarHBondContact O-N 3.32Å
1765	F	31.3	Very low	28.9	Very low	145 Å²	145	120.6 Å²	120.6	64%	0.636	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-72.6	6.1	170.1	-98	-94.8	0	0	0	114.2	R1761 V1763	R1761-F1765 VanDerWaalsContact O-CD2 3.25Å; R1761-F1765 WeakPolarHBondContact O-CD2 3.31Å; V1763-F1765 PolarHBondContact O-N 2.96Å
1766	R	29.9	Very low	28.9	Very low	187 Å²	187	111.2 Å²	111.2	71%	0.706	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-99.5	5.9	169.3	-77.4	-161.6	-177.2	-154.3	-6.7	115.1	V1763 V1764 L1781	V1763-R1766 PolarHBondContact O-N 3.39Å; V1764-R1766 PolarHBondContact O-N 2.62Å; V1764-R1766 VanDerWaalsContact O-N 3.08Å; R1766-L1781 HydrophobicContact CB-CD2 4.49Å; R1766-L1781 HydrophobicContact CG-CD2 3.38Å; R1766-L1781 VanDerWaalsContact CZ-CD1 3.49Å
1767	G	26.7	Very low	29	Very low	55 Å²	55	113.3 Å²	113.3	57%	0.567	74%	0.735	S	S	*	*	S	Bend	trans	-169.5	120.4	174.7	0	0	0	0	0	114.4	V1764	V1764-G1767 PolarHBondContact O-N 3.32Å
1768	G	28.4	Very low	29	Very low	80 Å²	80	111 Å²	111	83%	0.825	72%	0.721	S	S	*	*			trans	86.3	116.7	164.7	0	0	0	0	0	115.6
1769	G	25.6	Very low	29.4	Very low	89 Å²	89	114.8 Å²	114.8	92%	0.918	73%	0.727	S	S	*	*			trans	-90.1	-174.6	-165.4	0	0	0	0	0	118.5
1770	G	29.6	Very low	29.7	Very low	76 Å²	76	115.1 Å²	115.1	78%	0.784	73%	0.733	S	S	*	*			trans	161.6	73.4	170.9	0	0	0	0	0	116.6
1771	V	30.5	Very low	30	Very low	160 Å²	160	111.9 Å²	111.9	97%	0.97	71%	0.707	S	S	*	*			trans	45.4	115.4	142.7	-163.8	0	0	0	0	121.9
1772	G	27.1	Very low	30.1	Very low	71 Å²	71	110 Å²	110	73%	0.732	70%	0.704	S	S	*	*			trans	152.2	124.7	158.2	0	0	0	0	0	113.9
1773	P	27.2	Very low	30.4	Very low	142 Å²	142	110 Å²	110	92%	0.922	70%	0.702	S	S	*	*			trans	-93.4	141.6	-146.8	36.1	-34.1	0	0	0	115.4
1774	G	27.3	Very low	30.8	Very low	74 Å²	74	109.6 Å²	109.6	76%	0.763	69%	0.692	S	S	*	*			trans	176.2	122.8	171	0	0	0	0	0	113.1	G1776	G1774-G1776 PolarHBondContact O-N 3.35Å
1775	Q	28.8	Very low	30.9	Very low	204 Å²	204	110.9 Å²	110.9	95%	0.953	69%	0.693	S	S	*	*			trans	-60.8	102.8	-163.4	-67.5	161.9	-11.9	0	0	114.2
1776	G	28.2	Very low	31.2	Very low	55 Å²	55	106.5 Å²	106.5	57%	0.567	68%	0.68	S	S	*	*			trans	-137.6	141.3	-178.2	0	0	0	0	0	113.4	G1774 V1778	G1774-G1776 PolarHBondContact O-N 3.35Å; G1776-V1778 PolarHBondContact O-N 2.78Å
1777	P	29.9	Very low	31.8	Very low	104 Å²	104	100.6 Å²	100.6	68%	0.675	67%	0.668	S	S	*	*			trans	-85.5	99.7	-173.4	32.9	-33.1	0	0	0	112.6
1778	V	28.9	Very low	32.5	Very low	95 Å²	95	101.9 Å²	101.9	58%	0.576	66%	0.664	S	S	*	*			trans	-137.6	43.2	175.6	-165.4	0	0	0	0	110.1	G1776	G1776-V1778 PolarHBondContact O-N 2.78Å
1779	M	35.2	Very low	33.4	Very low	157 Å²	157	102.4 Å²	102.4	77%	0.773	65%	0.652	S	S	*	*			trans	-88.6	-26.6	178.7	-79.1	-137.3	-78.7	0	0	114.1	L1781 K1782 S1783	M1779-L1781 PolarHBondContact O-N 2.92Å; M1779-K1782 PolarHBondContact O-N 3.25Å; M1779-S1783 WeakPolarHBondContact O-CB 3Å; M1779-S1783 PolarHBondContact O-N 3.43Å; M1779-S1783 PolarHBondContact O-OG 3.09Å
1780	D	38.6	Very low	34.4	Very low	131 Å²	131	101.9 Å²	101.9	70%	0.701	63%	0.625	S	S	*	*	H	α-helix	trans	-60.7	-38.8	-167.1	-116.2	-7.7	0	0	0	114.2	S1783 E1784	D1780-S1783 WeakPolarHBondContact CA-OG 3.06Å; D1780-S1783 PolarHBondContact O-OG 3.26Å; D1780-E1784 VanDerWaalsContact O-CB 3.3Å; D1780-E1784 WeakPolarHBondContact O-CB 3.37Å; D1780-E1784 WeakPolarHBondContact O-CG 3.08Å; D1780-E1784 PolarHBondContact O-N 3.34Å
1781	L	35.5	Very low	35.3	Very low	44 Å²	44	99.9 Å²	99.9	23%	0.23	61%	0.605	C	S	.	*	H	α-helix	trans	-88.2	-24.2	-177.7	-150.6	90.5	0	0	0	114	R1766 M1779 M1785	R1766-L1781 HydrophobicContact CB-CD2 4.49Å; R1766-L1781 HydrophobicContact CG-CD2 3.38Å; R1766-L1781 VanDerWaalsContact CZ-CD1 3.49Å; M1779-L1781 PolarHBondContact O-N 2.92Å; L1781-M1785 WeakPolarHBondContact O-CA 2.97Å; L1781-M1785 WeakPolarHBondContact O-CB 3.21Å; L1781-M1785 PolarHBondContact O-N 3.43Å
1782	K	32.9	Very low	36.2	Very low	174 Å²	174	97 Å²	97	76%	0.757	58%	0.583	S	S	*	*	H	α-helix	trans	-77.3	-30.2	172.8	-162.5	177	-179.4	-176.9	0	109.7	M1779 S1786	M1779-K1782 PolarHBondContact O-N 3.25Å; K1782-S1786 WeakPolarHBondContact O-CA 3.35Å; K1782-S1786 WeakPolarHBondContact O-CB 3.23Å; K1782-S1786 PolarHBondContact O-N 3.05Å
1783	S	38.2	Very low	37.3	Very low	60 Å²	60	95.2 Å²	95.2	42%	0.42	57%	0.565	S	S	.	*	H	α-helix	trans	-75.6	-36.8	168.8	61.1	0	0	0	0	112.6	M1779 D1780 S1787	M1779-S1783 WeakPolarHBondContact O-CB 3Å; M1779-S1783 PolarHBondContact O-N 3.43Å; M1779-S1783 PolarHBondContact O-OG 3.09Å; D1780-S1783 WeakPolarHBondContact CA-OG 3.06Å; D1780-S1783 PolarHBondContact O-OG 3.26Å; S1783-S1787 WeakPolarHBondContact O-CB 3.35Å; S1783-S1787 PolarHBondContact O-N 2.66Å; S1783-S1787 PolarHBondContact O-OG 3.08Å
1784	E	37.1	Very low	38.5	Very low	109 Å²	109	92.6 Å²	92.6	51%	0.509	54%	0.541	S	S	.	.	H	α-helix	trans	-70.2	-40.3	172.5	-83	-175.1	158.5	0	0	112.1	D1780 S1787 V1788	D1780-E1784 VanDerWaalsContact O-CB 3.3Å; D1780-E1784 WeakPolarHBondContact O-CB 3.37Å; D1780-E1784 WeakPolarHBondContact O-CG 3.08Å; D1780-E1784 PolarHBondContact O-N 3.34Å; E1784-S1787 WeakPolarHBondContact CA-OG 3.22Å; E1784-S1787 PolarHBondContact O-N 3.05Å; E1784-S1787 PolarHBondContact O-OG 3.36Å; E1784-V1788 WeakPolarHBondContact O-CB 3.13Å; E1784-V1788 WeakPolarHBondContact O-CG2 3.39Å; E1784-V1788 PolarHBondContact O-N 3.4Å
1785	M	32.8	Very low	39.8	Very low	117 Å²	117	93.8 Å²	93.8	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-76.4	-30.3	176.9	-156.4	142.4	164.6	0	0	110.6	L1781 T1789	L1781-M1785 WeakPolarHBondContact O-CA 2.97Å; L1781-M1785 WeakPolarHBondContact O-CB 3.21Å; L1781-M1785 PolarHBondContact O-N 3.43Å; M1785-T1789 WeakPolarHBondContact O-CA 3.46Å; M1785-T1789 WeakPolarHBondContact O-CB 3.49Å; M1785-T1789 PolarHBondContact O-N 3.24Å; M1785-T1789 PolarHBondContact O-OG1 3.49Å
1786	S	37.7	Very low	41.1	Very low	52 Å²	52	88.6 Å²	88.6	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-66.6	-42.4	166	-172	0	0	0	0	111.1	K1782 T1789 E1790	K1782-S1786 WeakPolarHBondContact O-CA 3.35Å; K1782-S1786 WeakPolarHBondContact O-CB 3.23Å; K1782-S1786 PolarHBondContact O-N 3.05Å; S1786-T1789 PolarHBondContact O-N 3.07Å; S1786-E1790 WeakPolarHBondContact O-CA 3.45Å; S1786-E1790 WeakPolarHBondContact O-CB 3.4Å; S1786-E1790 WeakPolarHBondContact O-CG 3.45Å; S1786-E1790 PolarHBondContact O-N 3.14Å; S1786-E1790 PolarHBondContact OG-OE2 3.16Å; S1786-E1790 VanDerWaalsContact OG-OE2 3.05Å
1787	S	40.8	Very low	42.3	Very low	64 Å²	64	91.3 Å²	91.3	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-72.5	-31.1	179.4	73.2	0	0	0	0	112.8	S1783 E1784 G1791	S1783-S1787 WeakPolarHBondContact O-CB 3.35Å; S1783-S1787 PolarHBondContact O-N 2.66Å; S1783-S1787 PolarHBondContact O-OG 3.08Å; E1784-S1787 WeakPolarHBondContact CA-OG 3.22Å; E1784-S1787 PolarHBondContact O-N 3.05Å; E1784-S1787 PolarHBondContact O-OG 3.36Å; S1787-G1791 WeakPolarHBondContact O-CA 3.37Å; S1787-G1791 PolarHBondContact O-N 3.06Å
1788	V	41.8	Very low	43.8	Very low	81 Å²	81	92.8 Å²	92.8	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-76.5	-38.2	172.5	172.4	0	0	0	0	110.9	E1784 I1792	E1784-V1788 WeakPolarHBondContact O-CB 3.13Å; E1784-V1788 WeakPolarHBondContact O-CG2 3.39Å; E1784-V1788 PolarHBondContact O-N 3.4Å; V1788-I1792 HydrophobicContact CG1-CD1 3.78Å; V1788-I1792 HydrophobicContact CG1-CG1 4.48Å; V1788-I1792 VanDerWaalsContact O-CB 3.24Å; V1788-I1792 WeakPolarHBondContact O-CB 3.01Å; V1788-I1792 WeakPolarHBondContact O-CG1 3.37Å; V1788-I1792 PolarHBondContact O-N 2.92Å
1789	T	48.4	Very low	45.3	Very low	91 Å²	91	96 Å²	96	56%	0.558	50%	0.501	S	S	*	.	H	α-helix	trans	-75.9	-32.7	176.2	-47.8	0	0	0	0	111.5	M1785 S1786 G1793	M1785-T1789 WeakPolarHBondContact O-CA 3.46Å; M1785-T1789 WeakPolarHBondContact O-CB 3.49Å; M1785-T1789 PolarHBondContact O-N 3.24Å; M1785-T1789 PolarHBondContact O-OG1 3.49Å; S1786-T1789 PolarHBondContact O-N 3.07Å; T1789-G1793 WeakPolarHBondContact O-CA 3.33Å; T1789-G1793 PolarHBondContact O-N 3.36Å
1790	E	46.5	Very low	46.5	Very low	78 Å²	78	94.7 Å²	94.7	36%	0.364	49%	0.491	S	S	.	.	H	α-helix	trans	-72.5	-40.5	170.6	-75.5	172	140.8	0	0	110.4	S1786 G1793 M1794	S1786-E1790 WeakPolarHBondContact O-CA 3.45Å; S1786-E1790 WeakPolarHBondContact O-CB 3.4Å; S1786-E1790 WeakPolarHBondContact O-CG 3.45Å; S1786-E1790 PolarHBondContact O-N 3.14Å; S1786-E1790 PolarHBondContact OG-OE2 3.16Å; S1786-E1790 VanDerWaalsContact OG-OE2 3.05Å; E1790-G1793 CarbonylContact O-C 3.35Å; E1790-G1793 PolarHBondContact O-N 3.31Å; E1790-M1794 HydrophobicContact CB-CE 4.07Å; E1790-M1794 VanDerWaalsContact O-CB 3.28Å; E1790-M1794 WeakPolarHBondContact O-CB 3.45Å; E1790-M1794 WeakPolarHBondContact O-CG 3.28Å; E1790-M1794 PolarHBondContact O-N 2.96Å
1791	G	49	Very low	47.4	Very low	34 Å²	34	94.2 Å²	94.2	35%	0.351	48%	0.482	S	S	.	.	H	α-helix	trans	-67.4	-41.9	175	0	0	0	0	0	113.1	S1787 M1794 E1795	S1787-G1791 WeakPolarHBondContact O-CA 3.37Å; S1787-G1791 PolarHBondContact O-N 3.06Å; G1791-M1794 PolarHBondContact O-N 2.86Å; G1791-E1795 WeakPolarHBondContact O-CB 3.45Å; G1791-E1795 PolarHBondContact O-N 3.06Å
1792	I	48.3	Very low	48.8	Very low	101 Å²	101	97.7 Å²	97.7	52%	0.518	50%	0.497	S	S	.	.	H	α-helix	trans	-69.2	-37.3	172.7	-69.6	169.5	0	0	0	110.7	V1788 E1795 L1796	V1788-I1792 HydrophobicContact CG1-CD1 3.78Å; V1788-I1792 HydrophobicContact CG1-CG1 4.48Å; V1788-I1792 VanDerWaalsContact O-CB 3.24Å; V1788-I1792 WeakPolarHBondContact O-CB 3.01Å; V1788-I1792 WeakPolarHBondContact O-CG1 3.37Å; V1788-I1792 PolarHBondContact O-N 2.92Å; I1792-E1795 PolarHBondContact O-N 2.89Å; I1792-L1796 HydrophobicContact CG2-CD1 4.24Å; I1792-L1796 WeakPolarHBondContact O-CB 3.14Å; I1792-L1796 PolarHBondContact O-N 2.81Å
1793	G	49.5	Very low	50	Low	33 Å²	33	93 Å²	93	34%	0.34	48%	0.48	S	S	.	.	H	α-helix	trans	-61.8	-42.5	172.1	0	0	0	0	0	112.3	T1789 E1790 L1796 E1797	T1789-G1793 WeakPolarHBondContact O-CA 3.33Å; T1789-G1793 PolarHBondContact O-N 3.36Å; E1790-G1793 CarbonylContact O-C 3.35Å; E1790-G1793 PolarHBondContact O-N 3.31Å; G1793-L1796 PolarHBondContact O-N 2.99Å; G1793-E1797 WeakPolarHBondContact O-CB 3.25Å; G1793-E1797 PolarHBondContact O-N 3.48Å
1794	M	54	Low	50.7	Low	86 Å²	86	94.9 Å²	94.9	42%	0.424	49%	0.485	S	S	.	.	H	α-helix	trans	-66.4	-38.2	174.1	-76.9	-178.4	-135.3	0	0	111.8	E1790 G1791 E1797 K1798	E1790-M1794 HydrophobicContact CB-CE 4.07Å; E1790-M1794 VanDerWaalsContact O-CB 3.28Å; E1790-M1794 WeakPolarHBondContact O-CB 3.45Å; E1790-M1794 WeakPolarHBondContact O-CG 3.28Å; E1790-M1794 PolarHBondContact O-N 2.96Å; G1791-M1794 PolarHBondContact O-N 2.86Å; M1794-E1797 PolarHBondContact O-N 3.12Å; M1794-K1798 WeakPolarHBondContact O-CB 3.15Å; M1794-K1798 PolarHBondContact O-N 3Å
1795	E	54.6	Low	51.6	Low	100 Å²	100	94.5 Å²	94.5	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-71.2	-37.5	176.6	-168.4	64.8	-158.7	0	0	111.6	G1791 I1792 R1799	G1791-E1795 WeakPolarHBondContact O-CB 3.45Å; G1791-E1795 PolarHBondContact O-N 3.06Å; I1792-E1795 PolarHBondContact O-N 2.89Å; E1795-R1799 WeakPolarHBondContact O-CB 3.23Å; E1795-R1799 WeakPolarHBondContact O-CG 3.4Å; E1795-R1799 PolarHBondContact O-N 3.12Å
1796	L	55.4	Low	52.5	Low	95 Å²	95	94.9 Å²	94.9	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-67.4	-41.7	172.1	-111.1	141.4	0	0	0	111.6	I1792 G1793 R1799 F1800	I1792-L1796 HydrophobicContact CG2-CD1 4.24Å; I1792-L1796 WeakPolarHBondContact O-CB 3.14Å; I1792-L1796 PolarHBondContact O-N 2.81Å; G1793-L1796 PolarHBondContact O-N 2.99Å; L1796-R1799 CarbonylContact O-C 3.57Å; L1796-R1799 PolarHBondContact O-N 3.17Å; L1796-F1800 HydrophobicContact CD2-CD2 3.87Å; L1796-F1800 HydrophobicContact CD2-CE2 3.67Å; L1796-F1800 WeakPolarHBondContact O-CB 3.47Å; L1796-F1800 WeakPolarHBondContact O-CD2 3.37Å; L1796-F1800 PolarHBondContact O-N 3.31Å
1797	E	54	Low	52.7	Low	112 Å²	112	98.5 Å²	98.5	52%	0.523	50%	0.496	S	S	.	.	H	α-helix	trans	-70.3	-33.9	177.3	-164.9	172	-171.6	0	0	111.5	G1793 M1794 F1800 K1801	G1793-E1797 WeakPolarHBondContact O-CB 3.25Å; G1793-E1797 PolarHBondContact O-N 3.48Å; M1794-E1797 PolarHBondContact O-N 3.12Å; E1797-F1800 PolarHBondContact O-N 3.22Å; E1797-K1801 VanDerWaalsContact O-CB 3.3Å; E1797-K1801 WeakPolarHBondContact O-CB 3.27Å; E1797-K1801 WeakPolarHBondContact O-CG 3.19Å; E1797-K1801 PolarHBondContact O-N 3.45Å
1798	K	60.5	Low	53.1	Low	134 Å²	134	103 Å²	103	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-68	-40.4	170.7	-163.8	175	-171.6	175.9	0	111.3	M1794 K1801 E1802	M1794-K1798 WeakPolarHBondContact O-CB 3.15Å; M1794-K1798 PolarHBondContact O-N 3Å; K1798-K1801 PolarHBondContact O-N 3.22Å; K1798-E1802 WeakPolarHBondContact O-CB 3Å; K1798-E1802 PolarHBondContact O-N 2.94Å
1799	R	61.3	Low	53.3	Low	164 Å²	164	109.8 Å²	109.8	62%	0.619	53%	0.527	S	S	*	.	H	α-helix	trans	-67.2	-39.1	172	-70.3	-90.7	-179.8	166.7	-1.3	112.3	E1795 L1796 E1802 I1803	E1795-R1799 WeakPolarHBondContact O-CB 3.23Å; E1795-R1799 WeakPolarHBondContact O-CG 3.4Å; E1795-R1799 PolarHBondContact O-N 3.12Å; L1796-R1799 CarbonylContact O-C 3.57Å; L1796-R1799 PolarHBondContact O-N 3.17Å; R1799-E1802 PolarHBondContact O-N 2.99Å; R1799-I1803 WeakPolarHBondContact O-CB 3Å; R1799-I1803 WeakPolarHBondContact O-CD1 3.47Å; R1799-I1803 WeakPolarHBondContact O-CG1 3.39Å; R1799-I1803 PolarHBondContact O-N 3.03Å
1800	F	59.7	Low	52.9	Low	128 Å²	128	113.1 Å²	113.1	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-68.5	-38.5	174.3	-96.5	-77.8	0	0	0	111.4	L1796 E1797 I1803 D1804	L1796-F1800 HydrophobicContact CD2-CD2 3.87Å; L1796-F1800 HydrophobicContact CD2-CE2 3.67Å; L1796-F1800 WeakPolarHBondContact O-CB 3.47Å; L1796-F1800 WeakPolarHBondContact O-CD2 3.37Å; L1796-F1800 PolarHBondContact O-N 3.31Å; E1797-F1800 PolarHBondContact O-N 3.22Å; F1800-I1803 CarbonylContact O-C 3.54Å; F1800-I1803 PolarHBondContact O-N 3.27Å; F1800-D1804 WeakPolarHBondContact O-CB 3.34Å; F1800-D1804 PolarHBondContact O-N 3.3Å
1801	K	58	Low	52.6	Low	122 Å²	122	116.5 Å²	116.5	53%	0.53	56%	0.555	S	S	.	*	H	α-helix	trans	-68	-34.7	171.1	-85.2	-177.6	175.4	177.5	0	112.9	E1797 K1798 D1804 N1805	E1797-K1801 VanDerWaalsContact O-CB 3.3Å; E1797-K1801 WeakPolarHBondContact O-CB 3.27Å; E1797-K1801 WeakPolarHBondContact O-CG 3.19Å; E1797-K1801 PolarHBondContact O-N 3.45Å; K1798-K1801 PolarHBondContact O-N 3.22Å; K1801-D1804 PolarHBondContact O-N 3.41Å; K1801-N1805 VanDerWaalsContact O-CB 3.27Å; K1801-N1805 WeakPolarHBondContact O-CB 3.5Å; K1801-N1805 VanDerWaalsContact O-CG 3.31Å; K1801-N1805 PolarHBondContact O-N 3.02Å; K1801-N1805 PolarHBondContact O-ND2 2.88Å
1802	E	63.7	Low	52.6	Low	117 Å²	117	122 Å²	122	55%	0.547	58%	0.576	S	S	.	*	H	α-helix	trans	-67.3	-39.1	172.5	-160.1	92.1	-151.9	0	0	110.8	K1798 R1799 Q1806	K1798-E1802 WeakPolarHBondContact O-CB 3Å; K1798-E1802 PolarHBondContact O-N 2.94Å; R1799-E1802 PolarHBondContact O-N 2.99Å; E1802-Q1806 WeakPolarHBondContact O-CB 3.46Å; E1802-Q1806 VanDerWaalsContact O-CG 3.31Å; E1802-Q1806 WeakPolarHBondContact O-CG 3.49Å; E1802-Q1806 PolarHBondContact O-N 3.37Å
1803	I	59.9	Low	52.3	Low	76 Å²	76	120.6 Å²	120.6	39%	0.39	57%	0.572	S	S	.	*	H	α-helix	trans	-68.3	-42	173.1	-70.7	165.1	0	0	0	110.3	R1799 F1800 Q1806 F1807	R1799-I1803 WeakPolarHBondContact O-CB 3Å; R1799-I1803 WeakPolarHBondContact O-CD1 3.47Å; R1799-I1803 WeakPolarHBondContact O-CG1 3.39Å; R1799-I1803 PolarHBondContact O-N 3.03Å; F1800-I1803 CarbonylContact O-C 3.54Å; F1800-I1803 PolarHBondContact O-N 3.27Å; I1803-Q1806 CarbonylContact O-C 3.49Å; I1803-Q1806 PolarHBondContact O-N 3.08Å; I1803-Q1806 VanDerWaalsContact O-N 3.15Å; I1803-F1807 HydrophobicContact CG2-CD2 3.64Å; I1803-F1807 HydrophobicContact CG2-CE2 3.83Å; I1803-F1807 WeakPolarHBondContact O-CB 3.17Å; I1803-F1807 WeakPolarHBondContact O-CD2 3.4Å; I1803-F1807 PolarHBondContact O-N 3.28Å
1804	D	51.3	Low	51.9	Low	99 Å²	99	126.1 Å²	126.1	53%	0.529	59%	0.594	S	S	.	*	H	α-helix	trans	-64.3	-39.8	175	-105.4	-12.6	0	0	0	111.8	F1800 K1801 Q1806 F1807 Q1808	F1800-D1804 WeakPolarHBondContact O-CB 3.34Å; F1800-D1804 PolarHBondContact O-N 3.3Å; K1801-D1804 PolarHBondContact O-N 3.41Å; D1804-Q1806 VanDerWaalsContact C-N 3.3Å; D1804-Q1806 PolarHBondContact O-N 3.05Å; D1804-F1807 CarbonylContact O-C 3.56Å; D1804-F1807 PolarHBondContact O-N 3.45Å; D1804-Q1808 WeakPolarHBondContact O-CB 3.39Å; D1804-Q1808 WeakPolarHBondContact O-CG 3.5Å; D1804-Q1808 PolarHBondContact O-N 3.22Å
1805	N	57.2	Low	51.9	Low	101 Å²	101	127.2 Å²	127.2	54%	0.54	61%	0.61	S	S	.	*	H	α-helix	trans	-69.7	-26.3	173.3	-78.9	-19.4	0	0	0	112.5	K1801	K1801-N1805 VanDerWaalsContact O-CB 3.27Å; K1801-N1805 WeakPolarHBondContact O-CB 3.5Å; K1801-N1805 VanDerWaalsContact O-CG 3.31Å; K1801-N1805 PolarHBondContact O-N 3.02Å; K1801-N1805 PolarHBondContact O-ND2 2.88Å
1806	Q	51.2	Low	51.4	Low	125 Å²	125	130.1 Å²	130.1	58%	0.584	62%	0.616	S	S	*	*	H	α-helix	trans	-78.3	-33.6	169.4	-76.4	-175.6	3.5	0	0	112.3	E1802 I1803 D1804 R1809	E1802-Q1806 WeakPolarHBondContact O-CB 3.46Å; E1802-Q1806 VanDerWaalsContact O-CG 3.31Å; E1802-Q1806 WeakPolarHBondContact O-CG 3.49Å; E1802-Q1806 PolarHBondContact O-N 3.37Å; I1803-Q1806 CarbonylContact O-C 3.49Å; I1803-Q1806 PolarHBondContact O-N 3.08Å; I1803-Q1806 VanDerWaalsContact O-N 3.15Å; D1804-Q1806 VanDerWaalsContact C-N 3.3Å; D1804-Q1806 PolarHBondContact O-N 3.05Å; Q1806-R1809 PolarHBondContact O-N 3.2Å
1807	F	40.7	Very low	51	Low	128 Å²	128	130.5 Å²	130.5	56%	0.561	62%	0.618	S	S	*	*	H	α-helix	trans	-71.3	-34	174	-98.4	-87.3	0	0	0	112	I1803 D1804 R1809 F1810	I1803-F1807 HydrophobicContact CG2-CD2 3.64Å; I1803-F1807 HydrophobicContact CG2-CE2 3.83Å; I1803-F1807 WeakPolarHBondContact O-CB 3.17Å; I1803-F1807 WeakPolarHBondContact O-CD2 3.4Å; I1803-F1807 PolarHBondContact O-N 3.28Å; D1804-F1807 CarbonylContact O-C 3.56Å; D1804-F1807 PolarHBondContact O-N 3.45Å; F1807-R1809 PolarHBondContact O-N 3.13Å; F1807-F1810 PolarHBondContact O-N 3.3Å
1808	Q	50	Low	50.6	Low	157 Å²	157	131.8 Å²	131.8	73%	0.734	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-13.8	172.4	-79.8	-172.4	-1.2	0	0	113.6	D1804	D1804-Q1808 WeakPolarHBondContact O-CB 3.39Å; D1804-Q1808 WeakPolarHBondContact O-CG 3.5Å; D1804-Q1808 PolarHBondContact O-N 3.22Å
1809	R	46	Very low	50.3	Low	225 Å²	225	130 Å²	130	85%	0.849	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	1.5	174.6	-85.7	-176.4	174.1	177.2	0.6	114.9	Q1806 F1807	Q1806-R1809 PolarHBondContact O-N 3.2Å; F1807-R1809 PolarHBondContact O-N 3.13Å
1810	F	39.8	Very low	49.5	Very low	160 Å²	160	125.2 Å²	125.2	70%	0.702	62%	0.615	S	S	*	*			trans	-124.7	12.9	-168.3	-100.6	-76.8	0	0	0	118.2	F1807	F1807-F1810 PolarHBondContact O-N 3.3Å
1811	N	40.8	Very low	49.1	Very low	150 Å²	150	122.5 Å²	122.5	80%	0.802	61%	0.609	S	S	*	*			trans	-103.5	46	-177.7	-81	-16.5	0	0	0	116
1812	D	47.9	Very low	49.1	Very low	150 Å²	150	123 Å²	123	80%	0.802	61%	0.613	S	S	*	*			trans	-146.2	51	164.5	-153.7	16.4	0	0	0	113
1813	V	41.9	Very low	48.4	Very low	71 Å²	71	122.4 Å²	122.4	43%	0.43	61%	0.613	S	S	.	*			trans	-135.2	77.5	172.5	-170.4	0	0	0	0	111.3	S1815 R1816	V1813-S1815 PolarHBondContact O-N 2.75Å; V1813-R1816 HydrophobicContact CG1-CB 3.73Å; V1813-R1816 HydrophobicContact CG1-CG 3.79Å
1814	D	42.1	Very low	48.1	Very low	148 Å²	148	123.6 Å²	123.6	79%	0.791	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-3.3	167.8	-90.1	-31.5	0	0	0	114.1
1815	S	53.7	Low	48.5	Very low	109 Å²	109	122.3 Å²	122.3	76%	0.762	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	-1.8	-175.3	64	0	0	0	0	115.6	V1813	V1813-S1815 PolarHBondContact O-N 2.75Å
1816	R	43.8	Very low	48.7	Very low	161 Å²	161	121.5 Å²	121.5	61%	0.608	61%	0.611	S	S	*	*	S	Bend	trans	-122.4	11	176.3	-66.9	-174.1	166.2	-130.7	-2.5	113.1	V1813 N1818 D1819 V1820	V1813-R1816 HydrophobicContact CG1-CB 3.73Å; V1813-R1816 HydrophobicContact CG1-CG 3.79Å; R1816-N1818 PolarHBondContact O-N 2.73Å; R1816-D1819 PolarHBondContact O-N 2.81Å; R1816-V1820 HydrophobicContact CB-CG2 4.3Å; R1816-V1820 WeakPolarHBondContact O-CG2 3.5Å; R1816-V1820 PolarHBondContact O-N 2.68Å
1817	L	46.5	Very low	48.6	Very low	103 Å²	103	120.1 Å²	120.1	54%	0.539	61%	0.607	S	S	.	*	H	α-helix	trans	-56.1	-25.1	-177.7	-158.1	66.3	0	0	0	112.3	T1821	L1817-T1821 WeakPolarHBondContact O-CB 3.42Å; L1817-T1821 PolarHBondContact O-N 3.06Å; L1817-T1821 PolarHBondContact O-OG1 3.26Å
1818	N	47.3	Very low	49.2	Very low	139 Å²	139	117.4 Å²	117.4	74%	0.743	60%	0.604	S	S	*	*	H	α-helix	trans	-80.8	-30.4	172.9	-81.6	-19.3	0	0	0	115.1	R1816 Q1822	R1816-N1818 PolarHBondContact O-N 2.73Å; N1818-Q1822 PolarHBondContact O-N 3.24Å
1819	D	54	Low	49.9	Very low	97 Å²	97	115.3 Å²	115.3	52%	0.519	59%	0.594	S	S	.	*	H	α-helix	trans	-81.3	-32.3	175.5	-69.8	-15.9	0	0	0	111.1	R1816 Q1822 L1823	R1816-D1819 PolarHBondContact O-N 2.81Å; D1819-Q1822 PolarHBondContact O-N 2.85Å; D1819-L1823 PolarHBondContact O-N 3.42Å
1820	V	43.3	Very low	50.5	Low	64 Å²	64	108.7 Å²	108.7	39%	0.388	58%	0.579	S	S	.	*	H	α-helix	trans	-77.7	-28.5	175.6	177.4	0	0	0	0	111.1	R1816 L1823 L1824	R1816-V1820 HydrophobicContact CB-CG2 4.3Å; R1816-V1820 WeakPolarHBondContact O-CG2 3.5Å; R1816-V1820 PolarHBondContact O-N 2.68Å; V1820-L1823 PolarHBondContact O-N 3.44Å; V1820-L1824 HydrophobicContact CG1-CD1 3.77Å; V1820-L1824 HydrophobicContact CG1-CG 4.36Å; V1820-L1824 WeakPolarHBondContact O-CB 3.3Å; V1820-L1824 WeakPolarHBondContact O-CD1 3.31Å; V1820-L1824 WeakPolarHBondContact O-CG 3.42Å; V1820-L1824 PolarHBondContact O-N 2.65Å
1821	T	53	Low	51.5	Low	71 Å²	71	105.9 Å²	105.9	44%	0.436	57%	0.57	S	S	.	*	H	α-helix	trans	-69.1	-33.2	168	-54.6	0	0	0	0	111.5	L1817 T1825	L1817-T1821 WeakPolarHBondContact O-CB 3.42Å; L1817-T1821 PolarHBondContact O-N 3.06Å; L1817-T1821 PolarHBondContact O-OG1 3.26Å; T1821-T1825 VanDerWaalsContact O-CG2 3.31Å; T1821-T1825 WeakPolarHBondContact O-CG2 3.29Å; T1821-T1825 PolarHBondContact O-N 3.26Å; T1821-T1825 PolarHBondContact O-OG1 3.45Å; T1821-T1825 VanDerWaalsContact O-OG1 3.06Å
1822	Q	57.7	Low	52.7	Low	133 Å²	133	101.6 Å²	101.6	62%	0.621	55%	0.552	S	S	*	*	H	α-helix	trans	-72.5	-33.6	170	-82.9	-172	-9.3	0	0	113.4	N1818 D1819 T1825 N1826	N1818-Q1822 PolarHBondContact O-N 3.24Å; D1819-Q1822 PolarHBondContact O-N 2.85Å; Q1822-T1825 VanDerWaalsContact C-OG1 3.3Å; Q1822-T1825 VanDerWaalsContact CA-OG1 3.29Å; Q1822-T1825 WeakPolarHBondContact CA-OG1 3.45Å; Q1822-T1825 PolarHBondContact O-OG1 3.4Å; Q1822-N1826 PolarHBondContact O-N 3.49Å; Q1822-N1826 VanDerWaalsContact O-N 3.12Å; Q1822-N1826 PolarHBondContact O-ND2 3.32Å; Q1822-N1826 PolarHBondContact O-OD1 3.41Å
1823	L	47.6	Very low	53.7	Low	104 Å²	104	97.9 Å²	97.9	55%	0.545	53%	0.532	S	S	.	.	H	α-helix	trans	-75.8	-32.4	174.1	-85.5	162.3	0	0	0	113	D1819 V1820 N1826 L1827	D1819-L1823 PolarHBondContact O-N 3.42Å; V1820-L1823 PolarHBondContact O-N 3.44Å; L1823-N1826 CarbonylContact O-C 3.29Å; L1823-N1826 PolarHBondContact O-N 2.86Å; L1823-L1827 WeakPolarHBondContact O-CB 3.49Å; L1823-L1827 PolarHBondContact O-N 3.45Å
1824	L	53.9	Low	54.6	Low	101 Å²	101	98.3 Å²	98.3	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-72.9	-32.4	172.9	-86.6	157.8	0	0	0	111.8	V1820 L1827 S1828	V1820-L1824 HydrophobicContact CG1-CD1 3.77Å; V1820-L1824 HydrophobicContact CG1-CG 4.36Å; V1820-L1824 WeakPolarHBondContact O-CB 3.3Å; V1820-L1824 WeakPolarHBondContact O-CD1 3.31Å; V1820-L1824 WeakPolarHBondContact O-CG 3.42Å; V1820-L1824 PolarHBondContact O-N 2.65Å; L1824-L1827 PolarHBondContact O-N 2.77Å; L1824-S1828 WeakPolarHBondContact O-CB 3.49Å; L1824-S1828 PolarHBondContact O-N 2.92Å
1825	T	60.7	Low	55.6	Low	71 Å²	71	94.5 Å²	94.5	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-66.7	-40.6	167.4	49.4	0	0	0	0	111.1	T1821 Q1822 S1828 E1829	T1821-T1825 VanDerWaalsContact O-CG2 3.31Å; T1821-T1825 WeakPolarHBondContact O-CG2 3.29Å; T1821-T1825 PolarHBondContact O-N 3.26Å; T1821-T1825 PolarHBondContact O-OG1 3.45Å; T1821-T1825 VanDerWaalsContact O-OG1 3.06Å; Q1822-T1825 VanDerWaalsContact C-OG1 3.3Å; Q1822-T1825 VanDerWaalsContact CA-OG1 3.29Å; Q1822-T1825 WeakPolarHBondContact CA-OG1 3.45Å; Q1822-T1825 PolarHBondContact O-OG1 3.4Å; T1825-S1828 PolarHBondContact O-N 3.45Å; T1825-S1828 PolarHBondContact O-OG 2.73Å; T1825-E1829 PolarHBondContact O-N 3.5Å
1826	N	61.1	Low	56.4	Low	84 Å²	84	92.9 Å²	92.9	45%	0.449	50%	0.497	S	S	.	.	H	α-helix	trans	-70.1	-31.9	175.7	-65.7	-11.9	0	0	0	112.5	Q1822 L1823 E1829 V1830	Q1822-N1826 PolarHBondContact O-N 3.49Å; Q1822-N1826 VanDerWaalsContact O-N 3.12Å; Q1822-N1826 PolarHBondContact O-ND2 3.32Å; Q1822-N1826 PolarHBondContact O-OD1 3.41Å; L1823-N1826 CarbonylContact O-C 3.29Å; L1823-N1826 PolarHBondContact O-N 2.86Å; N1826-E1829 WeakPolarHBondContact O-CB 3.3Å; N1826-E1829 PolarHBondContact O-N 3.19Å; N1826-V1830 VanDerWaalsContact O-CG2 3.3Å; N1826-V1830 WeakPolarHBondContact O-CG2 3.19Å; N1826-V1830 PolarHBondContact O-N 3.27Å
1827	L	48.5	Very low	57.2	Low	96 Å²	96	88.4 Å²	88.4	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-73	-35.5	174	-126.1	101.1	0	0	0	111.5	L1823 L1824 E1829 V1830 I1831	L1823-L1827 WeakPolarHBondContact O-CB 3.49Å; L1823-L1827 PolarHBondContact O-N 3.45Å; L1824-L1827 PolarHBondContact O-N 2.77Å; L1827-E1829 PolarHBondContact O-N 2.81Å; L1827-V1830 PolarHBondContact O-N 2.97Å; L1827-I1831 HydrophobicContact CD2-CD1 4.24Å; L1827-I1831 WeakPolarHBondContact O-CB 3.46Å; L1827-I1831 VanDerWaalsContact O-CG1 3.3Å; L1827-I1831 WeakPolarHBondContact O-CG1 3.05Å; L1827-I1831 PolarHBondContact O-N 2.84Å
1828	S	53.9	Low	57.5	Low	71 Å²	71	89.3 Å²	89.3	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-33.5	170.9	86.2	0	0	0	0	111.2	L1824 T1825 S1832	L1824-S1828 WeakPolarHBondContact O-CB 3.49Å; L1824-S1828 PolarHBondContact O-N 2.92Å; T1825-S1828 PolarHBondContact O-N 3.45Å; T1825-S1828 PolarHBondContact O-OG 2.73Å; S1828-S1832 WeakPolarHBondContact O-CB 3.23Å; S1828-S1832 PolarHBondContact O-N 2.89Å
1829	E	65.4	Low	58.3	Low	113 Å²	113	87.7 Å²	87.7	53%	0.528	48%	0.477	S	S	.	.	H	α-helix	trans	-72.2	-35.5	174	-164.6	174.7	-170.3	0	0	111.8	T1825 N1826 L1827 N1833	T1825-E1829 PolarHBondContact O-N 3.5Å; N1826-E1829 WeakPolarHBondContact O-CB 3.3Å; N1826-E1829 PolarHBondContact O-N 3.19Å; L1827-E1829 PolarHBondContact O-N 2.81Å; E1829-N1833 WeakPolarHBondContact O-CB 3.48Å; E1829-N1833 PolarHBondContact O-N 2.94Å; E1829-N1833 PolarHBondContact O-ND2 2.6Å
1830	V	58.5	Low	58.7	Low	86 Å²	86	88.5 Å²	88.5	52%	0.521	47%	0.473	S	S	.	.	H	α-helix	trans	-73.4	-38.8	175	172.7	0	0	0	0	112.1	N1826 L1827 N1833 V1834	N1826-V1830 VanDerWaalsContact O-CG2 3.3Å; N1826-V1830 WeakPolarHBondContact O-CG2 3.19Å; N1826-V1830 PolarHBondContact O-N 3.27Å; L1827-V1830 PolarHBondContact O-N 2.97Å; V1830-N1833 PolarHBondContact O-N 2.98Å; V1830-V1834 HydrophobicContact CG1-CG2 4.49Å; V1830-V1834 WeakPolarHBondContact O-CB 3.09Å; V1830-V1834 VanDerWaalsContact O-CG2 3.27Å; V1830-V1834 WeakPolarHBondContact O-CG2 3.41Å; V1830-V1834 PolarHBondContact O-N 2.83Å
1831	I	59.9	Low	59.3	Low	102 Å²	102	89.5 Å²	89.5	52%	0.523	48%	0.475	S	S	.	.	H	α-helix	trans	-72.5	-38.7	176.3	-67.7	168	0	0	0	110.7	L1827 V1834 T1835	L1827-I1831 HydrophobicContact CD2-CD1 4.24Å; L1827-I1831 WeakPolarHBondContact O-CB 3.46Å; L1827-I1831 VanDerWaalsContact O-CG1 3.3Å; L1827-I1831 WeakPolarHBondContact O-CG1 3.05Å; L1827-I1831 PolarHBondContact O-N 2.84Å; I1831-V1834 PolarHBondContact O-N 3.42Å; I1831-T1835 WeakPolarHBondContact O-CB 3.28Å; I1831-T1835 WeakPolarHBondContact O-CG2 3.24Å; I1831-T1835 PolarHBondContact O-N 3.2Å; I1831-T1835 PolarHBondContact O-OG1 2.85Å
1832	S	67	Low	59.4	Low	60 Å²	60	90.6 Å²	90.6	42%	0.42	48%	0.477	S	S	.	.	H	α-helix	trans	-57.4	-49.7	166.5	169.8	0	0	0	0	110.3	S1828 V1834 T1835 E1836	S1828-S1832 WeakPolarHBondContact O-CB 3.23Å; S1828-S1832 PolarHBondContact O-N 2.89Å; S1832-V1834 PolarHBondContact O-N 2.95Å; S1832-T1835 WeakPolarHBondContact CA-OG1 3.27Å; S1832-T1835 PolarHBondContact O-N 3.39Å; S1832-T1835 PolarHBondContact O-OG1 2.91Å; S1832-E1836 WeakPolarHBondContact O-CB 3.41Å; S1832-E1836 PolarHBondContact O-N 3.49Å
1833	N	67.7	Low	59.2	Low	72 Å²	72	91 Å²	91	39%	0.385	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-37.8	178.1	-81.5	-35.9	0	0	0	112.7	E1829 V1830 T1837	E1829-N1833 WeakPolarHBondContact O-CB 3.48Å; E1829-N1833 PolarHBondContact O-N 2.94Å; E1829-N1833 PolarHBondContact O-ND2 2.6Å; V1830-N1833 PolarHBondContact O-N 2.98Å; N1833-T1837 WeakPolarHBondContact O-CB 3.07Å; N1833-T1837 PolarHBondContact O-N 3.42Å; N1833-T1837 PolarHBondContact O-OG1 2.66Å
1834	V	62.1	Low	59.2	Low	79 Å²	79	91.9 Å²	91.9	48%	0.479	48%	0.475	S	S	.	.	H	α-helix	trans	-72.4	-39.8	178.7	170.3	0	0	0	0	111.7	V1830 I1831 S1832 T1837 Q1838	V1830-V1834 HydrophobicContact CG1-CG2 4.49Å; V1830-V1834 WeakPolarHBondContact O-CB 3.09Å; V1830-V1834 VanDerWaalsContact O-CG2 3.27Å; V1830-V1834 WeakPolarHBondContact O-CG2 3.41Å; V1830-V1834 PolarHBondContact O-N 2.83Å; I1831-V1834 PolarHBondContact O-N 3.42Å; S1832-V1834 PolarHBondContact O-N 2.95Å; V1834-T1837 PolarHBondContact O-N 2.71Å; V1834-Q1838 WeakPolarHBondContact O-CB 3.33Å; V1834-Q1838 PolarHBondContact O-N 3.2Å
1835	T	63.2	Low	58.6	Low	68 Å²	68	92.2 Å²	92.2	42%	0.417	48%	0.476	S	S	.	.	H	α-helix	trans	-69.6	-36.6	173.9	50.5	0	0	0	0	111.7	I1831 S1832 T1837 Q1838 Q1839	I1831-T1835 WeakPolarHBondContact O-CB 3.28Å; I1831-T1835 WeakPolarHBondContact O-CG2 3.24Å; I1831-T1835 PolarHBondContact O-N 3.2Å; I1831-T1835 PolarHBondContact O-OG1 2.85Å; S1832-T1835 WeakPolarHBondContact CA-OG1 3.27Å; S1832-T1835 PolarHBondContact O-N 3.39Å; S1832-T1835 PolarHBondContact O-OG1 2.91Å; T1835-T1837 VanDerWaalsContact C-N 3.35Å; T1835-Q1838 PolarHBondContact O-N 2.86Å; T1835-Q1839 VanDerWaalsContact O-CB 3.27Å; T1835-Q1839 WeakPolarHBondContact O-CB 2.97Å; T1835-Q1839 WeakPolarHBondContact O-CG 3.15Å; T1835-Q1839 PolarHBondContact O-N 3.41Å
1836	E	69.6	Low	57.7	Low	76 Å²	76	95 Å²	95	36%	0.355	49%	0.488	S	S	.	.	H	α-helix	trans	-73.1	-26.3	173.5	-153.4	-170	-151.6	0	0	111.7	S1832 R1840	S1832-E1836 WeakPolarHBondContact O-CB 3.41Å; S1832-E1836 PolarHBondContact O-N 3.49Å; E1836-R1840 WeakPolarHBondContact O-CA 3.25Å; E1836-R1840 WeakPolarHBondContact O-CB 3.49Å; E1836-R1840 VanDerWaalsContact O-CG 3.28Å; E1836-R1840 WeakPolarHBondContact O-CG 3.3Å; E1836-R1840 PolarHBondContact O-N 3.48Å; E1836-R1840 IonicContact OE1-NH2 2.82Å; E1836-R1840 PolarHBondContact OE1-NH2 3.17Å; E1836-R1840 IonicContact OE2-CZ 3.4Å; E1836-R1840 VanDerWaalsContact OE2-CZ 3.24Å; E1836-R1840 IonicContact OE2-NH1 3.17Å; E1836-R1840 PolarHBondContact OE2-NH1 3.18Å; E1836-R1840 IonicContact OE2-NH2 2.79Å; E1836-R1840 PolarHBondContact OE2-NH2 3.31Å
1837	T	61.4	Low	57	Low	66 Å²	66	97 Å²	97	41%	0.405	49%	0.494	S	S	.	.	H	α-helix	trans	-78.1	-38.8	171.9	-51.7	0	0	0	0	111.2	N1833 V1834 T1835 R1840 I1841	N1833-T1837 WeakPolarHBondContact O-CB 3.07Å; N1833-T1837 PolarHBondContact O-N 3.42Å; N1833-T1837 PolarHBondContact O-OG1 2.66Å; V1834-T1837 PolarHBondContact O-N 2.71Å; T1835-T1837 VanDerWaalsContact C-N 3.35Å; T1837-R1840 PolarHBondContact O-N 3.01Å; T1837-I1841 HydrophobicContact CG2-CD1 4.01Å; T1837-I1841 HydrophobicContact CG2-CG1 4.49Å; T1837-I1841 WeakPolarHBondContact O-CB 3.48Å; T1837-I1841 WeakPolarHBondContact O-CD1 3.24Å; T1837-I1841 WeakPolarHBondContact O-CG1 3.4Å; T1837-I1841 PolarHBondContact O-N 2.92Å
1838	Q	52.8	Low	56.2	Low	123 Å²	123	98.1 Å²	98.1	58%	0.575	50%	0.5	S	S	*	.	H	α-helix	trans	-65	-41.9	169.7	-80.4	-170.7	-25.4	0	0	111.3	V1834 T1835 I1841 I1842	V1834-Q1838 WeakPolarHBondContact O-CB 3.33Å; V1834-Q1838 PolarHBondContact O-N 3.2Å; T1835-Q1838 PolarHBondContact O-N 2.86Å; Q1838-I1841 PolarHBondContact O-N 3.34Å; Q1838-I1842 WeakPolarHBondContact O-CB 3.12Å; Q1838-I1842 WeakPolarHBondContact O-CD1 3.25Å; Q1838-I1842 WeakPolarHBondContact O-CG1 3.42Å; Q1838-I1842 PolarHBondContact O-N 3.13Å
1839	Q	62.6	Low	55.2	Low	105 Å²	105	99.4 Å²	99.4	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-69.2	-34.4	173.5	-77.1	-176.5	-6.6	0	0	112.3	T1835 R1843	T1835-Q1839 VanDerWaalsContact O-CB 3.27Å; T1835-Q1839 WeakPolarHBondContact O-CB 2.97Å; T1835-Q1839 WeakPolarHBondContact O-CG 3.15Å; T1835-Q1839 PolarHBondContact O-N 3.41Å; Q1839-R1843 WeakPolarHBondContact O-CA 3.5Å; Q1839-R1843 WeakPolarHBondContact O-CB 3.19Å; Q1839-R1843 VanDerWaalsContact O-CG 3.24Å; Q1839-R1843 WeakPolarHBondContact O-CG 3.42Å; Q1839-R1843 PolarHBondContact O-N 2.92Å
1840	R	63.1	Low	53.4	Low	114 Å²	114	100.3 Å²	100.3	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-68.9	-35.7	170.5	-87	-175.9	-159.3	100	5.5	112.1	E1836 T1837 Q1844	E1836-R1840 WeakPolarHBondContact O-CA 3.25Å; E1836-R1840 WeakPolarHBondContact O-CB 3.49Å; E1836-R1840 VanDerWaalsContact O-CG 3.28Å; E1836-R1840 WeakPolarHBondContact O-CG 3.3Å; E1836-R1840 PolarHBondContact O-N 3.48Å; E1836-R1840 IonicContact OE1-NH2 2.82Å; E1836-R1840 PolarHBondContact OE1-NH2 3.17Å; E1836-R1840 IonicContact OE2-CZ 3.4Å; E1836-R1840 VanDerWaalsContact OE2-CZ 3.24Å; E1836-R1840 IonicContact OE2-NH1 3.17Å; E1836-R1840 PolarHBondContact OE2-NH1 3.18Å; E1836-R1840 IonicContact OE2-NH2 2.79Å; E1836-R1840 PolarHBondContact OE2-NH2 3.31Å; T1837-R1840 PolarHBondContact O-N 3.01Å; R1840-Q1844 WeakPolarHBondContact O-CA 3.23Å; R1840-Q1844 WeakPolarHBondContact O-CB 3.43Å; R1840-Q1844 WeakPolarHBondContact O-CG 3.49Å; R1840-Q1844 PolarHBondContact O-N 2.8Å
1841	I	56	Low	51.9	Low	84 Å²	84	101.8 Å²	101.8	43%	0.431	53%	0.533	S	S	.	.	H	α-helix	trans	-72.2	-41.4	176.6	-71.1	165.6	0	0	0	109.6	T1837 Q1838 Q1844 I1845	T1837-I1841 HydrophobicContact CG2-CD1 4.01Å; T1837-I1841 HydrophobicContact CG2-CG1 4.49Å; T1837-I1841 WeakPolarHBondContact O-CB 3.48Å; T1837-I1841 WeakPolarHBondContact O-CD1 3.24Å; T1837-I1841 WeakPolarHBondContact O-CG1 3.4Å; T1837-I1841 PolarHBondContact O-N 2.92Å; Q1838-I1841 PolarHBondContact O-N 3.34Å; I1841-Q1844 PolarHBondContact O-N 2.91Å; I1841-I1845 HydrophobicContact CG2-CD1 3.6Å; I1841-I1845 HydrophobicContact CG2-CG1 4.34Å; I1841-I1845 WeakPolarHBondContact O-CB 3.32Å; I1841-I1845 WeakPolarHBondContact O-CD1 3.15Å; I1841-I1845 WeakPolarHBondContact O-CG1 3.41Å; I1841-I1845 PolarHBondContact O-N 2.78Å
1842	I	55	Low	50.1	Low	95 Å²	95	104.4 Å²	104.4	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-67.5	-41.4	174.5	-68	165.5	0	0	0	110.8	Q1838 I1845 N1846	Q1838-I1842 WeakPolarHBondContact O-CB 3.12Å; Q1838-I1842 WeakPolarHBondContact O-CD1 3.25Å; Q1838-I1842 WeakPolarHBondContact O-CG1 3.42Å; Q1838-I1842 PolarHBondContact O-N 3.13Å; I1842-I1845 PolarHBondContact O-N 2.79Å; I1842-N1846 WeakPolarHBondContact O-CB 3.38Å; I1842-N1846 PolarHBondContact O-N 2.98Å; I1842-N1846 PolarHBondContact O-ND2 3.22Å
1843	R	54.1	Low	48.2	Very low	142 Å²	142	107.9 Å²	107.9	54%	0.536	57%	0.566	S	S	.	*	H	α-helix	trans	-65.9	-42.5	172.3	-81.1	-176.9	-177.2	145.6	2	111.6	Q1839 I1845 N1846 E1847	Q1839-R1843 WeakPolarHBondContact O-CA 3.5Å; Q1839-R1843 WeakPolarHBondContact O-CB 3.19Å; Q1839-R1843 VanDerWaalsContact O-CG 3.24Å; Q1839-R1843 WeakPolarHBondContact O-CG 3.42Å; Q1839-R1843 PolarHBondContact O-N 2.92Å; R1843-I1845 VanDerWaalsContact C-N 3.33Å; R1843-I1845 PolarHBondContact O-N 3.5Å; R1843-N1846 CarbonylContact O-C 3.48Å; R1843-N1846 WeakPolarHBondContact O-CA 3.22Å; R1843-N1846 PolarHBondContact O-N 2.95Å; R1843-N1846 VanDerWaalsContact O-N 3.08Å; R1843-E1847 WeakPolarHBondContact CB-OE1 3.33Å; R1843-E1847 WeakPolarHBondContact O-CA 3.41Å; R1843-E1847 WeakPolarHBondContact O-CB 3.41Å; R1843-E1847 VanDerWaalsContact O-CD 3.26Å; R1843-E1847 WeakPolarHBondContact O-CG 3.45Å; R1843-E1847 PolarHBondContact O-N 3.07Å
1844	Q	47.7	Very low	46.2	Very low	122 Å²	122	110.4 Å²	110.4	57%	0.57	58%	0.579	S	S	*	*	H	α-helix	trans	-69.5	-27.5	174.9	-76.7	175.9	-11.9	0	0	113.2	R1840 I1841 L1848	R1840-Q1844 WeakPolarHBondContact O-CA 3.23Å; R1840-Q1844 WeakPolarHBondContact O-CB 3.43Å; R1840-Q1844 WeakPolarHBondContact O-CG 3.49Å; R1840-Q1844 PolarHBondContact O-N 2.8Å; I1841-Q1844 PolarHBondContact O-N 2.91Å; Q1844-L1848 VanDerWaalsContact O-CB 3.29Å; Q1844-L1848 WeakPolarHBondContact O-CB 3.42Å; Q1844-L1848 WeakPolarHBondContact O-CG 3.46Å; Q1844-L1848 PolarHBondContact O-N 3.49Å; Q1844-L1848 VanDerWaalsContact O-N 3.13Å
1845	I	41.5	Very low	44.3	Very low	108 Å²	108	114.6 Å²	114.6	55%	0.554	59%	0.594	S	S	*	*	H	α-helix	trans	-74.4	-32.8	169.9	-71.1	166.2	0	0	0	110.4	I1841 I1842 R1843	I1841-I1845 HydrophobicContact CG2-CD1 3.6Å; I1841-I1845 HydrophobicContact CG2-CG1 4.34Å; I1841-I1845 WeakPolarHBondContact O-CB 3.32Å; I1841-I1845 WeakPolarHBondContact O-CD1 3.15Å; I1841-I1845 WeakPolarHBondContact O-CG1 3.41Å; I1841-I1845 PolarHBondContact O-N 2.78Å; I1842-I1845 PolarHBondContact O-N 2.79Å; R1843-I1845 VanDerWaalsContact C-N 3.33Å; R1843-I1845 PolarHBondContact O-N 3.5Å
1846	N	42	Very low	42.6	Very low	129 Å²	129	121.2 Å²	121.2	69%	0.69	62%	0.617	S	S	*	*	H	α-helix	trans	-88.8	-16.5	178	-72	-15.5	0	0	0	114.6	I1842 R1843	I1842-N1846 WeakPolarHBondContact O-CB 3.38Å; I1842-N1846 PolarHBondContact O-N 2.98Å; I1842-N1846 PolarHBondContact O-ND2 3.22Å; R1843-N1846 CarbonylContact O-C 3.48Å; R1843-N1846 WeakPolarHBondContact O-CA 3.22Å; R1843-N1846 PolarHBondContact O-N 2.95Å; R1843-N1846 VanDerWaalsContact O-N 3.08Å
1847	E	46.2	Very low	40.4	Very low	126 Å²	126	122.6 Å²	122.6	59%	0.589	63%	0.631	S	S	*	*	S	Bend	trans	-107.4	-2	179.1	-65.9	157.7	-178.5	0	0	111.1	R1843 P1849	R1843-E1847 WeakPolarHBondContact CB-OE1 3.33Å; R1843-E1847 WeakPolarHBondContact O-CA 3.41Å; R1843-E1847 WeakPolarHBondContact O-CB 3.41Å; R1843-E1847 VanDerWaalsContact O-CD 3.26Å; R1843-E1847 WeakPolarHBondContact O-CG 3.45Å; R1843-E1847 PolarHBondContact O-N 3.07Å; E1847-P1849 VanDerWaalsContact O-CD 3.3Å; E1847-P1849 WeakPolarHBondContact O-CD 3.24Å
1848	L	31	Very low	38.7	Very low	120 Å²	120	126 Å²	126	63%	0.628	65%	0.647	S	S	*	*	S	Bend	trans	-55.6	107.5	173.8	-124.6	174.3	0	0	0	107.7	Q1844 T1850	Q1844-L1848 VanDerWaalsContact O-CB 3.29Å; Q1844-L1848 WeakPolarHBondContact O-CB 3.42Å; Q1844-L1848 WeakPolarHBondContact O-CG 3.46Å; Q1844-L1848 PolarHBondContact O-N 3.49Å; Q1844-L1848 VanDerWaalsContact O-N 3.13Å; L1848-T1850 PolarHBondContact O-N 3.08Å
1849	P	32.5	Very low	37.2	Very low	98 Å²	98	128.1 Å²	128.1	64%	0.636	66%	0.657	S	S	*	*			trans	-65.3	113	-155.2	20.9	-31.1	0	0	0	111	E1847 C1851	E1847-P1849 VanDerWaalsContact O-CD 3.3Å; E1847-P1849 WeakPolarHBondContact O-CD 3.24Å; P1849-C1851 PolarHBondContact O-N 3.04Å
1850	T	27.1	Very low	35.4	Very low	131 Å²	131	129.4 Å²	129.4	80%	0.804	67%	0.671	S	S	*	*			trans	-57.3	84	157.4	46.2	0	0	0	0	108.1	L1848 Q1852	L1848-T1850 PolarHBondContact O-N 3.08Å; T1850-Q1852 PolarHBondContact O-N 3.42Å
1851	C	27.2	Very low	33.6	Very low	117 Å²	117	129.2 Å²	129.2	79%	0.791	68%	0.683	S	S	*	*			trans	-70.9	89.9	170.8	-69.1	0	0	0	0	108.4	P1849 C1853	P1849-C1851 PolarHBondContact O-N 3.04Å; C1851-C1853 PolarHBondContact O-N 2.99Å
1852	Q	23.7	Very low	32.2	Very low	157 Å²	157	130.2 Å²	130.2	73%	0.734	70%	0.695	S	S	*	*			trans	-41.1	129.4	150.8	-70.2	170	-20.4	0	0	109.3	T1850	T1850-Q1852 PolarHBondContact O-N 3.42Å
1853	C	26.1	Very low	30.9	Very low	134 Å²	134	132 Å²	132	91%	0.905	71%	0.71	S	S	*	*			trans	-143	111.6	138.7	-86.5	0	0	0	0	106.4	C1851	C1851-C1853 PolarHBondContact O-N 2.99Å
1854	N	24.8	Very low	29.4	Very low	124 Å²	124	132.6 Å²	132.6	66%	0.663	72%	0.718	S	S	*	*			trans	-62.2	163.3	-178.3	-69.9	-18.5	0	0	0	112.9
1855	E	23.2	Very low	28.4	Very low	168 Å²	168	136 Å²	136	79%	0.785	73%	0.732	S	S	*	*			trans	27.2	111.4	139.6	-64.3	175.7	146.2	0	0	116.1
1856	F	27.2	Very low	27.7	Very low	207 Å²	207	135.2 Å²	135.2	91%	0.908	74%	0.736	S	S	*	*				-149.4	129	129.4	-105.5	-76.2	0	0	0	109.8
1857	T	23.5	Very low	27	Very low	105 Å²	105	135.5 Å²	135.5	64%	0.644	74%	0.742	S	S	*	*			trans	-60.5	171.4	170.2	47.8	0	0	0	0	112.2
1858	D	25.1	Very low	25.9	Very low	137 Å²	137	134 Å²	134	73%	0.733	74%	0.741	S	S	*	*			trans	98.8	122.4	152.7	-59.7	-40.2	0	0	0	119.8
1859	E	22.7	Very low	25.6	Very low	168 Å²	168	132.4 Å²	132.4	79%	0.785	73%	0.731	S	S	*	*			trans	73.9	109.6	136.8	-70.9	-171.3	148.3	0	0	120.5
1860	V	25	Very low	25.5	Very low	131 Å²	131	131.1 Å²	131.1	79%	0.794	72%	0.716	S	S	*	*				39.7	150.9	105.8	-170.3	0	0	0	0	118.4
1861	V	24.8	Very low	26	Very low	111 Å²	111	128.8 Å²	128.8	67%	0.673	70%	0.702	S	S	*	*			trans	89	72.2	179.9	-164.7	0	0	0	0	114.5
1862	P	26	Very low	25.9	Very low	105 Å²	105	126.5 Å²	126.5	68%	0.682	68%	0.682	S	S	*	*			trans	-77	-149.8	160	37.1	-36.9	0	0	0	110.7
1863	V	27.4	Very low	26.1	Very low	132 Å²	132	125.6 Å²	125.6	80%	0.8	69%	0.693	S	S	*	*			trans	68.5	-176.7	-171.3	-167.1	0	0	0	0	111	K1865	V1863-K1865 PolarHBondContact O-N 3.49Å
1864	Q	22	Very low	26.6	Very low	154 Å²	154	121.1 Å²	121.1	72%	0.72	67%	0.669	S	S	*	*			trans	73.5	25.1	169.2	-46.5	-176.8	101.5	0	0	116.4	S1866	Q1864-S1866 PolarHBondContact O-OG 3.17Å
1865	K	28.4	Very low	26.7	Very low	195 Å²	195	121.5 Å²	121.5	85%	0.848	68%	0.676	S	S	*	*			trans	-137.7	124.3	168.9	-60.4	176.4	-173.9	172.9	0	107.3	V1863	V1863-K1865 PolarHBondContact O-N 3.49Å
1866	S	26.4	Very low	27	Very low	91 Å²	91	117.4 Å²	117.4	64%	0.636	67%	0.671	S	S	*	*			cis	58.3	95.5	2.6	64.7	0	0	0	0	116.5	Q1864	Q1864-S1866 PolarHBondContact O-OG 3.17Å
1867	T	26.9	Very low	27.1	Very low	135 Å²	135	113.4 Å²	113.4	83%	0.828	66%	0.655	S	S	*	*				-133.5	112.6	120.6	19.3	0	0	0	0	104
1868	T	23.9	Very low	27.4	Very low	93 Å²	93	114.1 Å²	114.1	57%	0.571	66%	0.659	S	S	*	*				30.7	116.8	65.9	53.9	0	0	0	0	110.6
1869	H	24.5	Very low	27.8	Very low	87 Å²	87	116 Å²	116	40%	0.403	66%	0.656	S	S	.	*			cis	178.7	162.4	19.3	-107.8	-66.4	0	0	0	105	S1333 E1334 Q1335	S1333-H1869 PolarHBondContact O-ND1 3.32Å; E1334-H1869 PolarHBondContact O-CE1 3.48Å; Q1335-H1869 HydrophobicContact CG-CB 4.07Å
1870	Q	29.4	Very low	28	Very low	72 Å²	72	117.1 Å²	117.1	34%	0.336	66%	0.658	S	S	.	*			trans	60.3	157.3	179.4	-62.3	118.9	-29.2	0	0	115.1	T1332 S1333 E1334	T1332-Q1870 CarbonylContact O-C 3.56Å; T1332-Q1870 VanDerWaalsContact O-C 3.3Å; T1332-Q1870 WeakPolarHBondContact O-CA 3.33Å; S1333-Q1870 PolarHBondContact O-N 2.96Å; E1334-Q1870 PolarHBondContact OE1-NE2 2.83Å; E1334-Q1870 VanDerWaalsContact OE2-CG 3.26Å; E1334-Q1870 WeakPolarHBondContact OE2-CG 3.23Å; E1334-Q1870 PolarHBondContact OE2-NE2 3.26Å
1871	T	37.2	Very low	28.4	Very low	82 Å²	82	119 Å²	119	50%	0.503	65%	0.651	S	S	.	*			cis	-131.8	141.6	-10.4	-16	0	0	0	0	109.4	T1332	T1332-T1871 CarbonylContact O-C 3.58Å; T1332-T1871 VanDerWaalsContact O-C 3.24Å; T1332-T1871 WeakPolarHBondContact O-CA 3.47Å; T1332-T1871 PolarHBondContact O-N 3.42Å
1872	D	25.8	Very low	29	Very low	69 Å²	69	118.6 Å²	118.6	37%	0.369	65%	0.649	S	S	.	*	S	Bend	trans	-60.1	140.5	164.1	-62.8	-80.5	0	0	0	110.6	T1332 S1333 G1874	T1332-D1872 VanDerWaalsContact N-CG 3.27Å; T1332-D1872 PolarHBondContact N-OD1 2.98Å; T1332-D1872 PolarHBondContact N-OD2 3.44Å; T1332-D1872 VanDerWaalsContact N-OD2 3.09Å; T1332-D1872 PolarHBondContact O-N 2.71Å; S1333-D1872 WeakPolarHBondContact CB-OD2 3.32Å; D1872-G1874 PolarHBondContact O-N 3.35Å
1873	S	28.6	Very low	29.3	Very low	138 Å²	138	122.5 Å²	122.5	97%	0.965	66%	0.656	S	S	*	*	S	Bend	trans	61.3	-45.6	-167.3	70	0	0	0	0	116.4
1874	G	35.1	Very low	29.6	Very low	39 Å²	39	122.3 Å²	122.3	40%	0.402	65%	0.649	S	S	.	*			trans	77.4	152.9	173.8	0	0	0	0	0	115.9	D1872	D1872-G1874 PolarHBondContact O-N 3.35Å
1875	T	27.2	Very low	30.5	Very low	133 Å²	133	121.5 Å²	121.5	82%	0.816	65%	0.646	S	S	*	*			trans	-150.8	138.9	-178.9	51.4	0	0	0	0	110.4
1876	A	31.2	Very low	31.4	Very low	82 Å²	82	114.5 Å²	114.5	68%	0.678	62%	0.619	S	S	*	*			cis	-156.6	-144	-10.8	0	0	0	0	0	107.9	T1878	A1876-T1878 VanDerWaalsContact C-N 3.28Å; A1876-T1878 PolarHBondContact O-N 2.72Å
1877	E	28.8	Very low	32.1	Very low	122 Å²	122	112.9 Å²	112.9	57%	0.57	61%	0.612	S	S	*	*			trans	64.9	-53.8	168.7	-71.7	-83.4	-100.2	0	0	117.7	R1879	E1877-R1879 HydrophobicContact CB-CB 4.11Å; E1877-R1879 PolarHBondContact O-N 3.27Å; E1877-R1879 WeakPolarHBondContact OE1-CD 3.26Å; E1877-R1879 IonicContact OE1-CZ 4Å; E1877-R1879 IonicContact OE1-NE 2.98Å; E1877-R1879 IonicContact OE1-NH1 3.63Å; E1877-R1879 PolarHBondContact OE1-NH1 3.16Å; E1877-R1879 IonicContact OE2-CZ 3.74Å; E1877-R1879 IonicContact OE2-NH1 2.65Å; E1877-R1879 PolarHBondContact OE2-NH1 3.17Å
1878	T	28.8	Very low	33.1	Very low	120 Å²	120	111.2 Å²	111.2	74%	0.736	60%	0.596	S	S	*	*			trans	57.7	-89.5	-157	70	0	0	0	0	111.7	A1876 K1880	A1876-T1878 VanDerWaalsContact C-N 3.28Å; A1876-T1878 PolarHBondContact O-N 2.72Å; T1878-K1880 VanDerWaalsContact O-CD 3.28Å; T1878-K1880 WeakPolarHBondContact O-CD 3.42Å; T1878-K1880 WeakPolarHBondContact O-CE 3.45Å; T1878-K1880 VanDerWaalsContact O-CG 3.25Å; T1878-K1880 WeakPolarHBondContact O-CG 3.09Å; T1878-K1880 PolarHBondContact O-N 3.41Å
1879	R	34.7	Very low	34.3	Very low	177 Å²	177	111.3 Å²	111.3	67%	0.668	59%	0.59	S	S	*	*			trans	58.4	-12	157.4	-147	171.5	-171.1	162.2	3.4	120	E1877 R1881	E1877-R1879 HydrophobicContact CB-CB 4.11Å; E1877-R1879 PolarHBondContact O-N 3.27Å; E1877-R1879 WeakPolarHBondContact OE1-CD 3.26Å; E1877-R1879 IonicContact OE1-CZ 4Å; E1877-R1879 IonicContact OE1-NE 2.98Å; E1877-R1879 IonicContact OE1-NH1 3.63Å; E1877-R1879 PolarHBondContact OE1-NH1 3.16Å; E1877-R1879 IonicContact OE2-CZ 3.74Å; E1877-R1879 IonicContact OE2-NH1 2.65Å; E1877-R1879 PolarHBondContact OE2-NH1 3.17Å; R1879-R1881 PolarHBondContact O-N 3.33Å
1880	K	26.3	Very low	35.8	Very low	191 Å²	191	110.6 Å²	110.6	83%	0.83	60%	0.595	S	S	*	*			trans	-77.3	51.8	-169.1	-65.6	146.3	-167.6	174.7	0	114.5	T1878 T1882	T1878-K1880 VanDerWaalsContact O-CD 3.28Å; T1878-K1880 WeakPolarHBondContact O-CD 3.42Å; T1878-K1880 WeakPolarHBondContact O-CE 3.45Å; T1878-K1880 VanDerWaalsContact O-CG 3.25Å; T1878-K1880 WeakPolarHBondContact O-CG 3.09Å; T1878-K1880 PolarHBondContact O-N 3.41Å; K1880-T1882 PolarHBondContact O-N 3.42Å
1881	R	32.5	Very low	36.6	Very low	170 Å²	170	110.1 Å²	110.1	64%	0.642	60%	0.603	S	S	*	*			trans	-62.8	107.1	179.3	-94.3	160	159	-161.5	1.2	111.8	R1879 V1886	R1879-R1881 PolarHBondContact O-N 3.33Å; R1881-V1886 HydrophobicContact CB-CG2 3.44Å; R1881-V1886 VanDerWaalsContact CB-CG2 3.44Å; R1881-V1886 HydrophobicContact CG-CG2 3.3Å
1882	T	37.5	Very low	37.1	Very low	103 Å²	103	111.1 Å²	111.1	63%	0.632	61%	0.605	S	S	*	*			trans	-67.7	132.4	159.5	46.4	0	0	0	0	107.6	K1880 L1884 E1885	K1880-T1882 PolarHBondContact O-N 3.42Å; T1882-L1884 PolarHBondContact O-N 3.38Å; T1882-E1885 PolarHBondContact O-N 3.12Å
1883	K	32.4	Very low	38.3	Very low	188 Å²	188	113.4 Å²	113.4	82%	0.817	61%	0.614	S	S	*	*	H	α-helix	trans	-52.8	-14.9	-164.1	-69.8	175.4	175.9	177.5	0	115.6	A1887	K1883-A1887 WeakPolarHBondContact O-CB 3.05Å; K1883-A1887 PolarHBondContact O-N 2.98Å
1884	L	33.9	Very low	39	Very low	127 Å²	127	109.9 Å²	109.9	67%	0.665	59%	0.593	S	S	*	*	H	α-helix	trans	-74	-43.8	-177.8	-163.5	69.2	0	0	0	113.2	T1882 V1886 A1887 I1888	T1882-L1884 PolarHBondContact O-N 3.38Å; L1884-V1886 VanDerWaalsContact C-N 3.34Å; L1884-V1886 PolarHBondContact O-N 3.08Å; L1884-A1887 PolarHBondContact O-N 3.34Å; L1884-I1888 HydrophobicContact CD1-CD1 4.43Å; L1884-I1888 HydrophobicContact CG-CD1 3.99Å; L1884-I1888 WeakPolarHBondContact O-CB 2.98Å; L1884-I1888 WeakPolarHBondContact O-CD1 3.11Å; L1884-I1888 VanDerWaalsContact O-CG1 3.22Å; L1884-I1888 WeakPolarHBondContact O-CG1 3.21Å; L1884-I1888 PolarHBondContact O-N 3.09Å
1885	E	42.2	Very low	39.5	Very low	137 Å²	137	110.8 Å²	110.8	64%	0.64	60%	0.597	S	S	*	*	H	α-helix	trans	-72.3	-28.6	178.3	-78.5	-178.6	156	0	0	112.2	T1882 Q1889	T1882-E1885 PolarHBondContact O-N 3.12Å; E1885-Q1889 WeakPolarHBondContact O-CB 3.26Å; E1885-Q1889 PolarHBondContact O-N 3.22Å
1886	V	45.8	Very low	40.4	Very low	48 Å²	48	109 Å²	109	29%	0.291	58%	0.578	S	S	.	*	H	α-helix	trans	-75.8	-37.3	173.9	-172.3	0	0	0	0	111.6	R1881 L1884 S1890	R1881-V1886 HydrophobicContact CB-CG2 3.44Å; R1881-V1886 VanDerWaalsContact CB-CG2 3.44Å; R1881-V1886 HydrophobicContact CG-CG2 3.3Å; L1884-V1886 VanDerWaalsContact C-N 3.34Å; L1884-V1886 PolarHBondContact O-N 3.08Å; V1886-S1890 WeakPolarHBondContact O-CB 3.49Å; V1886-S1890 PolarHBondContact O-N 3.21Å
1887	A	42.5	Very low	40.9	Very low	58 Å²	58	109.7 Å²	109.7	48%	0.479	57%	0.57	S	S	.	*	H	α-helix	trans	-67.3	-38.3	175.1	0	0	0	0	0	111.3	K1883 L1884 A1891	K1883-A1887 WeakPolarHBondContact O-CB 3.05Å; K1883-A1887 PolarHBondContact O-N 2.98Å; L1884-A1887 PolarHBondContact O-N 3.34Å; A1887-A1891 WeakPolarHBondContact O-CB 3.24Å; A1887-A1891 PolarHBondContact O-N 3.03Å
1888	I	47.3	Very low	41.5	Very low	99 Å²	99	109.9 Å²	109.9	51%	0.508	58%	0.579	S	S	.	*	H	α-helix	trans	-73.3	-42.3	178.2	-66.5	167.4	0	0	0	111.2	L1884 A1891 L1892	L1884-I1888 HydrophobicContact CD1-CD1 4.43Å; L1884-I1888 HydrophobicContact CG-CD1 3.99Å; L1884-I1888 WeakPolarHBondContact O-CB 2.98Å; L1884-I1888 WeakPolarHBondContact O-CD1 3.11Å; L1884-I1888 VanDerWaalsContact O-CG1 3.22Å; L1884-I1888 WeakPolarHBondContact O-CG1 3.21Å; L1884-I1888 PolarHBondContact O-N 3.09Å; I1888-A1891 PolarHBondContact O-N 3.11Å; I1888-L1892 WeakPolarHBondContact O-CB 3.33Å; I1888-L1892 PolarHBondContact O-N 3.05Å
1889	Q	49.8	Very low	42	Very low	96 Å²	96	110.9 Å²	110.9	45%	0.449	58%	0.579	S	S	.	*	H	α-helix	trans	-68.7	-39.7	175.8	-142.8	85.4	10.4	0	0	111.7	E1885 L1892 E1893	E1885-Q1889 WeakPolarHBondContact O-CB 3.26Å; E1885-Q1889 PolarHBondContact O-N 3.22Å; Q1889-L1892 PolarHBondContact O-N 2.97Å; Q1889-E1893 WeakPolarHBondContact O-CB 3.38Å; Q1889-E1893 PolarHBondContact O-N 3.19Å
1890	S	54.1	Low	41.9	Very low	72 Å²	72	110.7 Å²	110.7	50%	0.503	58%	0.578	S	S	.	*	H	α-helix	trans	-72.1	-30	177.5	-167.5	0	0	0	0	112.8	V1886 A1894	V1886-S1890 WeakPolarHBondContact O-CB 3.49Å; V1886-S1890 PolarHBondContact O-N 3.21Å; S1890-A1894 WeakPolarHBondContact O-CB 3.37Å; S1890-A1894 PolarHBondContact O-N 3.21Å
1891	A	47.2	Very low	42.4	Very low	61 Å²	61	106.6 Å²	106.6	50%	0.504	57%	0.571	S	S	.	*	H	α-helix	trans	-73.8	-37.7	171.1	0	0	0	0	0	111.5	A1887 I1888 A1895	A1887-A1891 WeakPolarHBondContact O-CB 3.24Å; A1887-A1891 PolarHBondContact O-N 3.03Å; I1888-A1891 PolarHBondContact O-N 3.11Å; A1891-A1895 VanDerWaalsContact O-CB 3.23Å; A1891-A1895 WeakPolarHBondContact O-CB 3.01Å; A1891-A1895 PolarHBondContact O-N 3.25Å
1892	L	47	Very low	42.7	Very low	103 Å²	103	104.5 Å²	104.5	54%	0.539	58%	0.58	S	S	.	*	H	α-helix	trans	-74	-24.3	176.3	-163.8	69.3	0	0	0	112.4	I1888 Q1889 K1896	I1888-L1892 WeakPolarHBondContact O-CB 3.33Å; I1888-L1892 PolarHBondContact O-N 3.05Å; Q1889-L1892 PolarHBondContact O-N 2.97Å; L1892-K1896 WeakPolarHBondContact O-CG 3.11Å; L1892-K1896 PolarHBondContact O-NZ 2.73Å
1893	E	51.2	Low	42.7	Very low	118 Å²	118	106 Å²	106	55%	0.551	59%	0.589	S	S	*	*	H	α-helix	trans	-88.7	-32.2	172.8	-83.2	161.6	159.7	0	0	113.2	Q1889 A1895 K1896	Q1889-E1893 WeakPolarHBondContact O-CB 3.38Å; Q1889-E1893 PolarHBondContact O-N 3.19Å; E1893-A1895 VanDerWaalsContact C-N 3.26Å; E1893-A1895 PolarHBondContact O-N 3.29Å; E1893-K1896 HydrophobicContact CG-CD 4.49Å; E1893-K1896 PolarHBondContact O-N 3.12Å
1894	A	44.6	Very low	43.5	Very low	64 Å²	64	102.5 Å²	102.5	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-66.9	-27.7	168.2	0	0	0	0	0	112.4	S1890 K1896	S1890-A1894 WeakPolarHBondContact O-CB 3.37Å; S1890-A1894 PolarHBondContact O-N 3.21Å; A1894-K1896 VanDerWaalsContact C-N 3.33Å
1895	A	43.8	Very low	43.8	Very low	58 Å²	58	102 Å²	102	48%	0.479	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.3	-6.3	173.8	0	0	0	0	0	114.7	A1891 E1893	A1891-A1895 VanDerWaalsContact O-CB 3.23Å; A1891-A1895 WeakPolarHBondContact O-CB 3.01Å; A1891-A1895 PolarHBondContact O-N 3.25Å; E1893-A1895 VanDerWaalsContact C-N 3.26Å; E1893-A1895 PolarHBondContact O-N 3.29Å
1896	K	46.5	Very low	43.5	Very low	96 Å²	96	101.2 Å²	101.2	42%	0.417	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	-87.7	-179.7	-75.6	177.8	-169.6	73.4	0	113	L1892 E1893 A1894 V1898 L1899	L1892-K1896 WeakPolarHBondContact O-CG 3.11Å; L1892-K1896 PolarHBondContact O-NZ 2.73Å; E1893-K1896 HydrophobicContact CG-CD 4.49Å; E1893-K1896 PolarHBondContact O-N 3.12Å; A1894-K1896 VanDerWaalsContact C-N 3.33Å; K1896-V1898 PolarHBondContact O-N 3.37Å; K1896-V1898 VanDerWaalsContact O-N 3.07Å; K1896-L1899 PolarHBondContact O-N 2.93Å
1897	D	41.7	Very low	43.7	Very low	96 Å²	96	104.6 Å²	104.6	51%	0.513	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.2	6	-155.4	-68	-24.8	0	0	0	114.2	L1899 R1900	D1897-L1899 VanDerWaalsContact C-N 3.28Å; D1897-R1900 IonicContact OD1-CZ 2.73Å; D1897-R1900 IonicContact OD1-NE 3.59Å; D1897-R1900 PolarHBondContact OD1-NE 2.92Å; D1897-R1900 IonicContact OD1-NH2 3.58Å; D1897-R1900 PolarHBondContact OD1-NH2 2.94Å; D1897-R1900 IonicContact OD2-CZ 3.74Å; D1897-R1900 IonicContact OD2-NE 3.51Å; D1897-R1900 IonicContact OD2-NH2 3.6Å; D1897-R1900 PolarHBondContact OD2-NH2 3.36Å
1898	V	41.9	Very low	43.4	Very low	125 Å²	125	107.1 Å²	107.1	76%	0.758	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-25.2	160.3	-177	0	0	0	0	111.2	K1896	K1896-V1898 PolarHBondContact O-N 3.37Å; K1896-V1898 VanDerWaalsContact O-N 3.07Å
1899	L	38.6	Very low	42.7	Very low	141 Å²	141	108.4 Å²	108.4	74%	0.738	65%	0.645	S	S	*	*	S	Bend	trans	-107.4	5	-176.4	-54.2	-179.8	0	0	0	113.4	K1896 D1897	K1896-L1899 PolarHBondContact O-N 2.93Å; D1897-L1899 VanDerWaalsContact C-N 3.28Å
1900	R	32.8	Very low	42.3	Very low	173 Å²	173	109.3 Å²	109.3	65%	0.653	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-78.4	123.2	175.8	-167.9	-172.9	-70	-155.1	3.3	109.4	D1897	D1897-R1900 IonicContact OD1-CZ 2.73Å; D1897-R1900 IonicContact OD1-NE 3.59Å; D1897-R1900 PolarHBondContact OD1-NE 2.92Å; D1897-R1900 IonicContact OD1-NH2 3.58Å; D1897-R1900 PolarHBondContact OD1-NH2 2.94Å; D1897-R1900 IonicContact OD2-CZ 3.74Å; D1897-R1900 IonicContact OD2-NE 3.51Å; D1897-R1900 IonicContact OD2-NH2 3.6Å; D1897-R1900 PolarHBondContact OD2-NH2 3.36Å
1901	P	37.9	Very low	41.3	Very low	106 Å²	106	111.7 Å²	111.7	69%	0.688	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-70.3	146.4	171.7	26.2	-30.1	0	0	0	111.1	T1903	P1901-T1903 PolarHBondContact O-N 2.88Å
1902	P	37.6	Very low	40.8	Very low	126 Å²	126	114.3 Å²	114.3	82%	0.818	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-74.9	119.2	-177.9	28.7	-31.6	0	0	0	111.3
1903	T	37.8	Very low	40.7	Very low	135 Å²	135	114.4 Å²	114.4	83%	0.828	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-73.5	128.7	171.7	39.5	0	0	0	0	111.2	P1901	P1901-T1903 PolarHBondContact O-N 2.88Å
1904	P	49.5	Very low	39.6	Very low	113 Å²	113	115 Å²	115	73%	0.734	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-69.7	154.8	-179.7	26.2	-32.5	0	0	0	113.4
1905	P	40.5	Very low	38.8	Very low	116 Å²	116	120.6 Å²	120.6	75%	0.753	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-70.2	151.1	-179.7	28.9	-33.4	0	0	0	112.2
1906	P	36.1	Very low	38.1	Very low	121 Å²	121	120.7 Å²	120.7	79%	0.786	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-68.7	136.1	-176.2	27.8	-32.9	0	0	0	111.4
1907	P	50.4	Low	37.1	Very low	119 Å²	119	124.2 Å²	124.2	77%	0.773	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-68.7	147.2	173	25.5	-30.4	0	0	0	111.6
1908	P	35.9	Very low	36.3	Very low	111 Å²	111	126.7 Å²	126.7	72%	0.721	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-72.7	154.5	-175.5	29.8	-33.8	0	0	0	112.3	P1910	P1908-P1910 WeakPolarHBondContact O-CD 3.26Å
1909	P	32.2	Very low	35.7	Very low	126 Å²	126	124.5 Å²	124.5	82%	0.818	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-70.8	127.5	-178.3	28.3	-32.1	0	0	0	111.3
1910	P	41.3	Very low	35.2	Very low	115 Å²	115	124 Å²	124	75%	0.747	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-77.5	151.4	169.4	-9.5	26.5	0	0	0	111.9	P1908	P1908-P1910 WeakPolarHBondContact O-CD 3.26Å
1911	P	32.5	Very low	34.9	Very low	123 Å²	123	121.4 Å²	121.4	80%	0.799	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-84.5	159.7	-165.7	35.2	-35.9	0	0	0	113.9
1912	P	37.5	Very low	34.2	Very low	116 Å²	116	123.4 Å²	123.4	75%	0.753	75%	0.754	S	S	*	*			trans	-126.9	165.1	163.6	39.1	-29.1	0	0	0	113.6
1913	P	44	Very low	33.8	Very low	104 Å²	104	124 Å²	124	68%	0.675	75%	0.75	S	S	*	*			cis	-111.7	-143.7	-7.3	31.3	-10	0	0	0	111	Q1915	P1913-Q1915 HydrophobicContact CG-CG 4.36Å
1914	P	27.8	Very low	33.1	Very low	130 Å²	130	122.6 Å²	122.6	84%	0.844	75%	0.752	S	S	*	*				-132.3	142.8	81.2	19.4	1.5	0	0	0	114.8
1915	Q	29.7	Very low	32	Very low	182 Å²	182	120.4 Å²	120.4	85%	0.85	74%	0.744	S	S	*	*			trans	-63.2	145.2	170	-69.4	169.7	-32.6	0	0	112.5	P1913	P1913-Q1915 HydrophobicContact CG-CG 4.36Å
1916	G	28.1	Very low	31.3	Very low	60 Å²	60	120.8 Å²	120.8	62%	0.619	74%	0.743	S	S	*	*			trans	-106.2	-170.7	147.7	0	0	0	0	0	110.6
1917	K	25.6	Very low	30.9	Very low	170 Å²	170	121.6 Å²	121.6	74%	0.739	75%	0.746	S	S	*	*			cis	65.2	134.4	15	-50.8	-157.1	150.2	-69.5	0	114.4
1918	E	25.6	Very low	29.7	Very low	148 Å²	148	121.3 Å²	121.3	69%	0.692	74%	0.744	S	S	*	*			cis	-152	156.6	-14.8	-139.8	97.6	-93	0	0	106.2
1919	S	28	Very low	29.4	Very low	79 Å²	79	119 Å²	119	55%	0.552	74%	0.74	S	S	*	*			cis	-144.2	169	3	84.2	0	0	0	0	109.6	V1921	S1919-V1921 PolarHBondContact O-N 3.32Å
1920	P	29.2	Very low	29.5	Very low	130 Å²	130	118 Å²	118	84%	0.844	74%	0.737	S	S	*	*			trans	-77.5	-12.1	-172.1	30.7	-35.8	0	0	0	116
1921	V	25.7	Very low	28.8	Very low	119 Å²	119	121.6 Å²	121.6	72%	0.721	74%	0.743	S	S	*	*			trans	64.3	155.1	-176.7	-169.4	0	0	0	0	114.3	S1919	S1919-V1921 PolarHBondContact O-N 3.32Å
1922	L	24	Very low	28.8	Very low	148 Å²	148	122.5 Å²	122.5	78%	0.775	74%	0.741	S	S	*	*			trans	-153.6	162.4	-177.3	-92.7	170.4	0	0	0	110.3
1923	L	27.7	Very low	28.6	Very low	139 Å²	139	123.8 Å²	123.8	73%	0.728	74%	0.742	S	S	*	*			trans	92.1	99.2	169.5	-59.2	124.2	0	0	0	114	A1925	L1923-A1925 VanDerWaalsContact C-N 3.25Å; L1923-A1925 HydrophobicContact CB-CB 4.07Å; L1923-A1925 HydrophobicContact CD2-CB 3.73Å
1924	A	24.7	Very low	28	Very low	105 Å²	105	123.8 Å²	123.8	87%	0.868	74%	0.744	S	S	*	*			cis	38.3	51.3	24.9	0	0	0	0	0	112.3
1925	A	26.4	Very low	28.3	Very low	68 Å²	68	123.1 Å²	123.1	56%	0.562	74%	0.743	S	S	*	*			trans	-117.2	106.2	160.5	0	0	0	0	0	106.1	L1923	L1923-A1925 VanDerWaalsContact C-N 3.25Å; L1923-A1925 HydrophobicContact CB-CB 4.07Å; L1923-A1925 HydrophobicContact CD2-CB 3.73Å
1926	V	25.9	Very low	28.4	Very low	123 Å²	123	117.7 Å²	117.7	75%	0.745	74%	0.735	S	S	*	*				74.1	93.5	84.4	171.2	0	0	0	0	109.7	P1928	V1926-P1928 HydrophobicContact CG1-CG 4.22Å
1927	V	27.6	Very low	28.8	Very low	138 Å²	138	120.4 Å²	120.4	84%	0.836	75%	0.745	S	S	*	*			trans	-73.5	132.3	146.3	176.2	0	0	0	0	106.3
1928	P	25.2	Very low	29.2	Very low	113 Å²	113	121.8 Å²	121.8	73%	0.734	75%	0.754	S	S	*	*				-145.2	104.8	119.8	29.2	-8.2	0	0	0	109.5	V1926	V1926-P1928 HydrophobicContact CG1-CG 4.22Å
1929	G	28	Very low	29.8	Very low	62 Å²	62	123.6 Å²	123.6	64%	0.639	76%	0.763	S	S	*	*			trans	-125.8	73.5	169.6	0	0	0	0	0	108.9
1930	S	34.9	Very low	30	Very low	107 Å²	107	122.3 Å²	122.3	75%	0.748	76%	0.762	S	S	*	*			trans	12.6	106	155.3	54.4	0	0	0	0	116.4	D1932	S1930-D1932 PolarHBondContact O-N 2.88Å
1931	E	26.2	Very low	30	Very low	190 Å²	190	120 Å²	120	89%	0.888	76%	0.762	S	S	*	*			trans	-58.1	122.5	145.8	-63.2	178.8	153.6	0	0	107.9
1932	D	33.8	Very low	30.5	Very low	141 Å²	141	120.9 Å²	120.9	75%	0.754	76%	0.763	S	S	*	*			trans	-136.8	101.2	146.2	-84	-33.3	0	0	0	106.4	S1930	S1930-D1932 PolarHBondContact O-N 2.88Å
1933	D	32.9	Very low	31.2	Very low	143 Å²	143	119.9 Å²	119.9	77%	0.765	77%	0.765	S	S	*	*				70.1	102.6	128.6	-67.3	-15.5	0	0	0	120.9
1934	S	31.5	Very low	32.1	Very low	104 Å²	104	117.8 Å²	117.8	73%	0.727	76%	0.762	S	S	*	*				104.9	127.1	99.7	-167.9	0	0	0	0	118.8
1935	S	33.6	Very low	33.5	Very low	117 Å²	117	115.4 Å²	115.4	82%	0.818	74%	0.742	S	S	*	*			trans	73.7	129.3	156.3	75.3	0	0	0	0	116.7
1936	G	32.4	Very low	35.3	Very low	67 Å²	67	113.7 Å²	113.7	69%	0.691	72%	0.724	S	S	*	*			cis	134.7	138.8	16.1	0	0	0	0	0	108.9
1937	S	36.6	Very low	36.8	Very low	118 Å²	118	111 Å²	111	83%	0.825	71%	0.709	S	S	*	*			trans	83.9	94.9	-178.1	72.3	0	0	0	0	115.5
1938	E	34.2	Very low	38.7	Very low	198 Å²	198	107.2 Å²	107.2	93%	0.925	69%	0.686	S	S	*	*				70.5	61.6	79.1	-66.7	-162.4	169	0	0	114.6
1939	E	36.4	Very low	40.7	Very low	186 Å²	186	106.4 Å²	106.4	87%	0.869	68%	0.675	S	S	*	*			trans	-163.1	168.5	131.5	-104.8	-67.9	90.5	0	0	107.1
1940	G	33.5	Very low	42.6	Very low	52 Å²	52	105.8 Å²	105.8	54%	0.536	66%	0.658	S	S	.	*			cis	-163.7	160.6	-1.8	0	0	0	0	0	113.1	D1942	G1940-D1942 PolarHBondContact O-N 3.22Å
1941	G	29.5	Very low	44.1	Very low	82 Å²	82	101.6 Å²	101.6	85%	0.845	63%	0.629	S	S	*	*			trans	-90.7	61.5	-163.5	0	0	0	0	0	116.8
1942	D	36.2	Very low	45.8	Very low	138 Å²	138	100.3 Å²	100.3	74%	0.738	62%	0.623	S	S	*	*			trans	-80.3	132.8	-171.7	-144.2	4.7	0	0	0	113.8	G1940 S1944	G1940-D1942 PolarHBondContact O-N 3.22Å; D1942-S1944 PolarHBondContact O-N 3.36Å
1943	P	37.4	Very low	47	Very low	126 Å²	126	95.4 Å²	95.4	82%	0.818	60%	0.598	S	S	*	*	S	Bend	trans	-68	25.1	-178	-18.2	32	0	0	0	117.2	A1945	P1943-A1945 PolarHBondContact O-N 2.84Å
1944	S	47.5	Very low	48.2	Very low	95 Å²	95	95.3 Å²	95.3	66%	0.664	61%	0.605	S	S	*	*			trans	-94.7	42.9	-175.2	-172.4	0	0	0	0	114.1	D1942 D1946	D1942-S1944 PolarHBondContact O-N 3.36Å; S1944-D1946 PolarHBondContact O-N 3.38Å
1945	A	54.1	Low	49.7	Very low	56 Å²	56	94.4 Å²	94.4	46%	0.463	59%	0.592	S	S	.	*	S	Bend	trans	-65.5	-33.8	-163.8	0	0	0	0	0	116.8	P1943	P1943-A1945 PolarHBondContact O-N 2.84Å
1946	D	63.2	Low	50.9	Low	32 Å²	32	94.5 Å²	94.5	17%	0.171	58%	0.582	C	S	.	*			trans	-157	117.2	171.7	-163.5	43.5	0	0	0	109.8	S1944 V1948 R2162	S1944-D1946 PolarHBondContact O-N 3.38Å; D1946-V1948 PolarHBondContact O-N 3.43Å; D1946-R2162 HydrophobicContact CB-CB 4.37Å; D1946-R2162 WeakPolarHBondContact OD1-CD 3.3Å; D1946-R2162 IonicContact OD1-CZ 2.87Å; D1946-R2162 IonicContact OD1-NE 3.22Å; D1946-R2162 IonicContact OD1-NH1 3.22Å; D1946-R2162 PolarHBondContact OD1-NH1 3.09Å
1947	P	58.7	Low	51.9	Low	67 Å²	67	98.8 Å²	98.8	44%	0.435	58%	0.582	S	S	.	*			trans	-72.5	120.2	178	27.3	-32.2	0	0	0	111.3	T1965	P1947-T1965 WeakPolarHBondContact CG-OG1 3.49Å
1948	V	67.7	Low	53.3	Low	58 Å²	58	95.3 Å²	95.3	35%	0.352	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.2	128.5	179.8	-173.9	0	0	0	0	109.8	D1946 V1950 I1962 R1964	D1946-V1948 PolarHBondContact O-N 3.43Å; V1948-V1950 HydrophobicContact CG1-CG2 3.65Å; V1948-I1962 HydrophobicContact CG1-CG2 3.71Å; V1948-R1964 HydrophobicContact CG1-CG 4.39Å; V1948-R1964 HydrophobicContact CG2-CG 4.27Å
1949	L	66.6	Low	54.8	Low	96 Å²	96	85.9 Å²	85.9	50%	0.503	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	121.8	168.6	-114.1	80.1	0	0	0	109.5	E1963 P2016	L1949-E1963 HydrophobicContact CB-CB 4.26Å; L1949-E1963 PolarHBondContact N-O 2.87Å; L1949-E1963 PolarHBondContact O-N 3.18Å; L1949-E1963 VanDerWaalsContact O-N 3.17Å; L1949-P2016 HydrophobicContact CB-CB 4.14Å; L1949-P2016 HydrophobicContact CD2-CB 3.72Å; L1949-P2016 HydrophobicContact CG-CB 4.49Å
1950	V	67.3	Low	56.7	Low	48 Å²	48	78.2 Å²	78.2	29%	0.291	48%	0.475	S	S	.	.			trans	-125.5	119.2	178.6	-172.7	0	0	0	0	109.6	V1948 Q1952 I1962	V1948-V1950 HydrophobicContact CG1-CG2 3.65Å; V1950-Q1952 PolarHBondContact O-NE2 3.01Å; V1950-I1962 HydrophobicContact CG2-CG2 4.4Å
1951	P	65.8	Low	58.7	Low	20 Å²	20	76 Å²	76	13%	0.13	45%	0.451	C	S	.	.			trans	-60.8	137.1	171	-19.1	30.1	0	0	0	110.7	V1953 R1960 V1961 L2014 P2016	P1951-V1953 WeakPolarHBondContact O-CG2 3.49Å; P1951-R1960 HydrophobicContact CG-CB 4.44Å; P1951-V1961 WeakPolarHBondContact CD-O 3.39Å; P1951-L2014 HydrophobicContact CB-CB 3.98Å; P1951-L2014 HydrophobicContact CG-CB 4.38Å; P1951-P2016 HydrophobicContact CG-CG 4.33Å
1952	Q	62.1	Low	61.1	Low	162 Å²	162	72 Å²	72	76%	0.757	41%	0.411	S	S	*	.			trans	-90.9	135.8	179.7	-58	-55.7	-66	0	0	110.1	V1950	V1950-Q1952 PolarHBondContact O-NE2 3.01Å
1953	V	59.2	Low	63.3	Low	39 Å²	39	66.4 Å²	66.4	24%	0.236	38%	0.38	C	S	.	.			trans	-134.4	131.3	-161.9	-163.6	0	0	0	0	111	P1951 D1955 T1958 R1960 L2014	P1951-V1953 WeakPolarHBondContact O-CG2 3.49Å; V1953-D1955 VanDerWaalsContact CG1-O 3.23Å; V1953-D1955 WeakPolarHBondContact CG1-O 3.28Å; V1953-T1958 WeakPolarHBondContact CG1-OG1 3.44Å; V1953-R1960 HydrophobicContact CG2-CB 4.37Å; V1953-L2014 HydrophobicContact CG1-CD1 4.11Å; V1953-L2014 HydrophobicContact CG2-CD1 3.97Å
1954	P	59.1	Low	65.4	Low	140 Å²	140	60.7 Å²	60.7	91%	0.909	34%	0.342	S	S	*	.	S	Bend	trans	-76.6	-20.5	179.1	26.9	-31.4	0	0	0	114.8
1955	D	62.7	Low	66.8	Low	85 Å²	85	58.9 Å²	58.9	46%	0.455	33%	0.327	S	S	.	.	S	Bend	trans	-122.7	136.4	177.2	-171.5	-7.5	0	0	0	110.6	V1953 K1957 T1958	V1953-D1955 VanDerWaalsContact CG1-O 3.23Å; V1953-D1955 WeakPolarHBondContact CG1-O 3.28Å; D1955-K1957 PolarHBondContact O-N 2.89Å; D1955-K1957 PolarHBondContact OD1-N 3.38Å; D1955-K1957 VanDerWaalsContact OD1-N 3.12Å; D1955-T1958 PolarHBondContact O-N 2.68Å; D1955-T1958 PolarHBondContact O-OG1 2.92Å; D1955-T1958 VanDerWaalsContact O-OG1 3.06Å
1956	I	58	Low	67.8	Low	120 Å²	120	56.5 Å²	56.5	62%	0.615	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-17	179.8	-60.5	167.2	0	0	0	111
1957	K	54.5	Low	68.3	Low	157 Å²	157	57.9 Å²	57.9	68%	0.683	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-16.5	-178.7	-64.4	178.1	-178.9	175.8	0	115	D1955 F1979	D1955-K1957 PolarHBondContact O-N 2.89Å; D1955-K1957 PolarHBondContact OD1-N 3.38Å; D1955-K1957 VanDerWaalsContact OD1-N 3.12Å; K1957-F1979 WeakPolarHBondContact O-CE2 3.41Å
1958	T	64.8	Low	69	Low	44 Å²	44	60.9 Å²	60.9	27%	0.27	34%	0.34	S	S	.	.	S	Bend	trans	-76.9	131	-176.6	-9.6	0	0	0	0	111.1	V1953 D1955	V1953-T1958 WeakPolarHBondContact CG1-OG1 3.44Å; D1955-T1958 PolarHBondContact O-N 2.68Å; D1955-T1958 PolarHBondContact O-OG1 2.92Å; D1955-T1958 VanDerWaalsContact O-OG1 3.06Å
1959	G	67.6	Low	69.6	Low	1 Å²	1	59.2 Å²	59.2	1%	0.01	33%	0.328	C	S	.	.			trans	-67	133.7	179.9	0	0	0	0	0	112.3	L2014	G1959-L2014 PolarHBondContact O-N 3.21Å
1960	R	74.5	Confident	70.3	Confident	24 Å²	24	56.5 Å²	56.5	9%	0.091	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	144.9	176.5	57	177.8	-177.3	-112.1	2.6	111.1	P1951 V1953 A1975 P2232 N2233	P1951-R1960 HydrophobicContact CG-CB 4.44Å; V1953-R1960 HydrophobicContact CG2-CB 4.37Å; R1960-A1975 HydrophobicContact CG-CB 4.44Å; R1960-A1975 VanDerWaalsContact CG-O 3.23Å; R1960-A1975 WeakPolarHBondContact CG-O 3.29Å; R1960-A1975 PolarHBondContact N-O 2.94Å; R1960-A1975 PolarHBondContact O-N 2.79Å; R1960-P2232 PolarHBondContact NH2-O 3.27Å; R1960-N2233 PolarHBondContact NH2-O 3.45Å
1961	V	77	Confident	71.1	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.03	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.5	170.8	-173.1	0	0	0	0	108.9	P1951 W1972 L2013 L2014 F2015	P1951-V1961 WeakPolarHBondContact CD-O 3.39Å; V1961-W1972 HydrophobicContact CG1-CB 3.82Å; V1961-W1972 HydrophobicContact CG1-CD2 4.38Å; V1961-W1972 HydrophobicContact CG1-CE3 3.73Å; V1961-W1972 HydrophobicContact CG1-CG 4.48Å; V1961-L2013 HydrophobicContact CG2-CD2 3.55Å; V1961-L2014 PolarHBondContact N-O 3.38Å; V1961-L2014 VanDerWaalsContact N-O 3.1Å; V1961-F2015 HydrophobicContact CB-CD1 4.27Å; V1961-F2015 HydrophobicContact CG2-CD1 3.81Å; V1961-F2015 HydrophobicContact CG2-CE1 3.78Å
1962	I	79.3	Confident	71.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120.7	176	-58.6	173.2	0	0	0	108.1	V1948 V1950 W1972 R1973 A1975	V1948-I1962 HydrophobicContact CG1-CG2 3.71Å; V1950-I1962 HydrophobicContact CG2-CG2 4.4Å; I1962-W1972 WeakPolarHBondContact O-CA 3.34Å; I1962-R1973 PolarHBondContact N-O 3.5Å; I1962-R1973 PolarHBondContact O-N 2.99Å; I1962-A1975 HydrophobicContact CD1-CB 3.83Å; I1962-A1975 HydrophobicContact CG1-CB 4.4Å
1963	E	81.6	Confident	72.9	Confident	20 Å²	20	46.4 Å²	46.4	9%	0.093	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.2	178.1	-177.3	-179.1	178.3	0	0	111.1	L1949 R1970 W1972 P2016	L1949-E1963 HydrophobicContact CB-CB 4.26Å; L1949-E1963 PolarHBondContact N-O 2.87Å; L1949-E1963 PolarHBondContact O-N 3.18Å; L1949-E1963 VanDerWaalsContact O-N 3.17Å; E1963-R1970 VanDerWaalsContact OE1-CD 3.28Å; E1963-R1970 WeakPolarHBondContact OE1-CD 3.48Å; E1963-W1972 HydrophobicContact CB-CE3 3.73Å; E1963-W1972 HydrophobicContact CB-CH2 4.42Å; E1963-W1972 HydrophobicContact CB-CZ3 3.62Å; E1963-W1972 VanDerWaalsContact CD-CZ3 3.4Å; E1963-W1972 HydrophobicContact CG-CD2 4.46Å; E1963-W1972 HydrophobicContact CG-CE3 3.87Å; E1963-W1972 HydrophobicContact CG-CH2 3.87Å; E1963-W1972 HydrophobicContact CG-CZ2 4.48Å; E1963-W1972 HydrophobicContact CG-CZ3 3.56Å; E1963-W1972 WeakPolarHBondContact OE2-CH2 3.4Å; E1963-W1972 VanDerWaalsContact OE2-CZ3 3.3Å; E1963-W1972 WeakPolarHBondContact OE2-CZ3 3.15Å; E1963-P2016 HydrophobicContact CB-CG 3.93Å
1964	R	82.6	Confident	73.9	Confident	6 Å²	6	45.4 Å²	45.4	2%	0.023	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.3	172.8	-60.9	-177.2	167.4	100.7	10.1	110	V1948 L1971 E2231	V1948-R1964 HydrophobicContact CG1-CG 4.39Å; V1948-R1964 HydrophobicContact CG2-CG 4.27Å; R1964-L1971 HydrophobicContact CB-CB 4.24Å; R1964-L1971 PolarHBondContact N-O 3.08Å; R1964-L1971 PolarHBondContact O-N 2.72Å; R1964-E2231 IonicContact CZ-OE1 3.09Å; R1964-E2231 IonicContact CZ-OE2 2.66Å; R1964-E2231 IonicContact NH1-OE1 2.81Å; R1964-E2231 PolarHBondContact NH1-OE1 2.9Å; R1964-E2231 IonicContact NH1-OE2 3.72Å; R1964-E2231 IonicContact NH2-OE1 3.02Å; R1964-E2231 PolarHBondContact NH2-OE1 2.97Å; R1964-E2231 IonicContact NH2-OE2 3.95Å; R1964-E2231 PolarHBondContact NH2-OE2 3.47Å
1965	T	76.7	Confident	74.6	Confident	56 Å²	56	38.8 Å²	38.8	34%	0.344	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	110.4	178.6	45.1	0	0	0	0	110.9	P1947 R1970 R2162	P1947-T1965 WeakPolarHBondContact CG-OG1 3.49Å; T1965-R1970 HydrophobicContact CG2-CG 4.45Å; T1965-R2162 PolarHBondContact O-NH1 3.39Å
1966	L	74.8	Confident	74.8	Confident	7 Å²	7	35.5 Å²	35.5	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	91.8	-179.1	-74.5	155.5	0	0	0	109.2	D1968 H1969 L1971 I2155 S2158 L2159	L1966-D1968 PolarHBondContact O-N 2.82Å; L1966-H1969 PolarHBondContact N-O 3.35Å; L1966-H1969 WeakPolarHBondContact O-CB 3.11Å; L1966-H1969 PolarHBondContact O-N 3.3Å; L1966-L1971 HydrophobicContact CD1-CB 4.22Å; L1966-L1971 HydrophobicContact CD1-CD2 3.78Å; L1966-I2155 HydrophobicContact CD1-CG2 4.13Å; L1966-S2158 WeakPolarHBondContact CD2-OG 3.36Å; L1966-L2159 HydrophobicContact CD1-CB 4.1Å; L1966-L2159 HydrophobicContact CD1-CD1 4.16Å
1967	G	73.2	Confident	75.4	Confident	60 Å²	60	30.4 Å²	30.4	62%	0.619	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	-128.3	-173.8	0	0	0	0	0	111.1	H1969	G1967-H1969 PolarHBondContact O-N 3.18Å
1968	D	74.7	Confident	76	Confident	130 Å²	130	24.3 Å²	24.3	70%	0.695	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	7.4	176.5	-65	-19.2	0	0	0	113.1	L1966 T2143	L1966-D1968 PolarHBondContact O-N 2.82Å; D1968-T2143 HydrophobicContact CB-CG2 4.04Å; D1968-T2143 WeakPolarHBondContact O-CG2 3.45Å
1969	H	79.8	Confident	75.7	Confident	23 Å²	23	24.6 Å²	24.6	11%	0.106	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.9	-176	-63.2	-63.2	0	0	0	113	L1966 G1967 D2141 C2146 C2151 I2155	L1966-H1969 PolarHBondContact N-O 3.35Å; L1966-H1969 WeakPolarHBondContact O-CB 3.11Å; L1966-H1969 PolarHBondContact O-N 3.3Å; G1967-H1969 PolarHBondContact O-N 3.18Å; H1969-D2141 PolarHBondContact ND1-O 3.13Å; H1969-C2146 PolarHBondContact CE1-SG 2.96Å; H1969-C2146 PolarHBondContact NE2-SG 3.23Å; H1969-C2151 PolarHBondContact CE1-SG 2.87Å; H1969-C2151 PolarHBondContact NE2-SG 3.31Å; H1969-I2155 HydrophobicContact CB-CD1 3.92Å; H1969-I2155 HydrophobicContact CB-CG1 4.17Å
1970	R	80.2	Confident	75.3	Confident	40 Å²	40	26.4 Å²	26.4	15%	0.151	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.4	167.8	-62.9	-176.4	-68.2	-159.1	-2.3	109.2	E1963 T1965 W1972 T2140 D2141	E1963-R1970 VanDerWaalsContact OE1-CD 3.28Å; E1963-R1970 WeakPolarHBondContact OE1-CD 3.48Å; T1965-R1970 HydrophobicContact CG2-CG 4.45Å; R1970-W1972 HydrophobicContact CB-CZ2 3.86Å; R1970-W1972 HydrophobicContact CG-CZ2 4.42Å; R1970-T2140 WeakPolarHBondContact O-CA 3.1Å; R1970-D2141 HydrophobicContact CB-CB 4.27Å; R1970-D2141 IonicContact CZ-OD2 3.83Å; R1970-D2141 IonicContact NE-OD2 3.67Å; R1970-D2141 PolarHBondContact NE-OD2 3.26Å; R1970-D2141 IonicContact NH2-OD2 3.06Å; R1970-D2141 PolarHBondContact NH2-OD2 2.81Å; R1970-D2141 PolarHBondContact O-N 2.91Å
1971	L	84.1	Confident	74.2	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.2	179.1	-173.6	78	0	0	0	109.2	R1964 L1966 F2097 Y2138 L2139 T2140 I2155 L2159	R1964-L1971 HydrophobicContact CB-CB 4.24Å; R1964-L1971 PolarHBondContact N-O 3.08Å; R1964-L1971 PolarHBondContact O-N 2.72Å; L1966-L1971 HydrophobicContact CD1-CB 4.22Å; L1966-L1971 HydrophobicContact CD1-CD2 3.78Å; L1971-F2097 HydrophobicContact CD1-CD1 4.36Å; L1971-F2097 HydrophobicContact CD1-CE1 3.29Å; L1971-F2097 HydrophobicContact CD1-CZ 3.71Å; L1971-Y2138 HydrophobicContact CD1-CD1 4.19Å; L1971-Y2138 HydrophobicContact CD1-CG 3.92Å; L1971-Y2138 HydrophobicContact CD2-CD1 3.64Å; L1971-Y2138 HydrophobicContact CD2-CE1 4.11Å; L1971-Y2138 HydrophobicContact CD2-CG 4.06Å; L1971-Y2138 HydrophobicContact CG-CD1 3.83Å; L1971-Y2138 HydrophobicContact CG-CG 4.09Å; L1971-L2139 CarbonylContact C-O 3.56Å; L1971-L2139 WeakPolarHBondContact CA-O 3.45Å; L1971-T2140 HydrophobicContact CD1-CG2 3.51Å; L1971-I2155 HydrophobicContact CD1-CG2 4.18Å; L1971-L2159 HydrophobicContact CD2-CD1 3.83Å; L1971-L2159 HydrophobicContact CD2-CD2 4.09Å; L1971-L2159 HydrophobicContact CD2-CG 4.5Å
1972	W	82.9	Confident	72.9	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.015	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.4	-178.5	-37.2	83.3	0	0	0	111.2	V1961 I1962 E1963 R1970 P2016 Y2138 L2139	V1961-W1972 HydrophobicContact CG1-CB 3.82Å; V1961-W1972 HydrophobicContact CG1-CD2 4.38Å; V1961-W1972 HydrophobicContact CG1-CE3 3.73Å; V1961-W1972 HydrophobicContact CG1-CG 4.48Å; I1962-W1972 WeakPolarHBondContact O-CA 3.34Å; E1963-W1972 HydrophobicContact CB-CE3 3.73Å; E1963-W1972 HydrophobicContact CB-CH2 4.42Å; E1963-W1972 HydrophobicContact CB-CZ3 3.62Å; E1963-W1972 VanDerWaalsContact CD-CZ3 3.4Å; E1963-W1972 HydrophobicContact CG-CD2 4.46Å; E1963-W1972 HydrophobicContact CG-CE3 3.87Å; E1963-W1972 HydrophobicContact CG-CH2 3.87Å; E1963-W1972 HydrophobicContact CG-CZ2 4.48Å; E1963-W1972 HydrophobicContact CG-CZ3 3.56Å; E1963-W1972 WeakPolarHBondContact OE2-CH2 3.4Å; E1963-W1972 VanDerWaalsContact OE2-CZ3 3.3Å; E1963-W1972 WeakPolarHBondContact OE2-CZ3 3.15Å; R1970-W1972 HydrophobicContact CB-CZ2 3.86Å; R1970-W1972 HydrophobicContact CG-CZ2 4.42Å; W1972-P2016 HydrophobicContact CZ3-CG 4.11Å; W1972-Y2138 WeakPolarHBondContact O-CA 3.37Å; W1972-L2139 HydrophobicContact CB-CB 4.04Å; W1972-L2139 HydrophobicContact CG-CB 4.34Å; W1972-L2139 PolarHBondContact N-O 3.15Å; W1972-L2139 PolarHBondContact O-N 2.98Å
1973	R	83.5	Confident	71.4	Confident	10 Å²	10	46.3 Å²	46.3	4%	0.038	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129	167.4	178.8	177.9	173.3	164.8	0.2	110	I1962 L2127 Y2138 L2229 E2231 E2236	I1962-R1973 PolarHBondContact N-O 3.5Å; I1962-R1973 PolarHBondContact O-N 2.99Å; R1973-L2127 VanDerWaalsContact NH2-CD1 3.3Å; R1973-Y2138 HydrophobicContact CB-CD1 3.99Å; R1973-Y2138 HydrophobicContact CB-CE1 4.17Å; R1973-L2229 PolarHBondContact NH1-O 3.25Å; R1973-E2231 WeakPolarHBondContact CD-OE1 3.47Å; R1973-E2231 IonicContact CZ-OE1 2.73Å; R1973-E2231 IonicContact NE-OE1 2.74Å; R1973-E2231 IonicContact NH1-OE1 3.18Å; R1973-E2231 PolarHBondContact NH1-OE1 3.26Å; R1973-E2236 IonicContact CZ-OE2 2.65Å; R1973-E2236 IonicContact NE-OE2 2.94Å; R1973-E2236 IonicContact NH2-OE2 2.94Å; R1973-E2236 PolarHBondContact NH2-OE2 3.23Å
1974	M	80.8	Confident	70	Confident	19 Å²	19	48.7 Å²	48.7	9%	0.094	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.1	171.6	-58.5	174.6	92.4	0	0	109	L2013 L2087 W2137 L2197	M1974-L2013 HydrophobicContact CE-CD1 3.33Å; M1974-L2013 HydrophobicContact CE-CD2 3.76Å; M1974-L2013 HydrophobicContact CE-CG 4.21Å; M1974-L2087 HydrophobicContact CE-CB 4.41Å; M1974-W2137 HydrophobicContact CG-CH2 4.34Å; M1974-W2137 HydrophobicContact SD-CH2 3.73Å; M1974-W2137 HydrophobicContact SD-CZ2 4.32Å; M1974-L2197 HydrophobicContact SD-CD1 4.28Å
1975	A	72.7	Confident	68.9	Low	1 Å²	1	51 Å²	51	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	121.9	178.9	0	0	0	0	0	109.9	R1960 I1962 T2234	R1960-A1975 HydrophobicContact CG-CB 4.44Å; R1960-A1975 VanDerWaalsContact CG-O 3.23Å; R1960-A1975 WeakPolarHBondContact CG-O 3.29Å; R1960-A1975 PolarHBondContact N-O 2.94Å; R1960-A1975 PolarHBondContact O-N 2.79Å; I1962-A1975 HydrophobicContact CD1-CB 3.83Å; I1962-A1975 HydrophobicContact CG1-CB 4.4Å; A1975-T2234 HydrophobicContact CB-CG2 4.06Å
1976	P	66.8	Low	68.6	Low	16 Å²	16	52.2 Å²	52.2	10%	0.104	28%	0.284	C	S	.	.	S	Bend	cis	-72.8	150.6	2.1	-14.5	30.4	0	0	0	114.1	N1978 R2129 E2236	P1976-N1978 PolarHBondContact O-N 3.31Å; P1976-R2129 VanDerWaalsContact CB-NE 3.33Å; P1976-E2236 WeakPolarHBondContact CA-OE1 3.41Å
1977	F	71.4	Confident	68.8	Low	12 Å²	12	52.7 Å²	52.7	5%	0.053	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-3.7	-176	72.1	-111.7	0	0	0	116.1	L2127 R2129 C2134 E2236	F1977-L2127 HydrophobicContact CD1-CB 4.14Å; F1977-L2127 HydrophobicContact CE1-CB 3.73Å; F1977-L2127 HydrophobicContact CZ-CB 4.42Å; F1977-L2127 VanDerWaalsContact CZ-O 3.28Å; F1977-L2127 WeakPolarHBondContact CZ-O 3.41Å; F1977-R2129 HydrophobicContact CE1-CB 3.66Å; F1977-R2129 HydrophobicContact CZ-CB 3.72Å; F1977-C2134 HydrophobicContact CD2-CB 3.92Å; F1977-C2134 WeakPolarHBondContact CD2-SG 3.33Å; F1977-C2134 HydrophobicContact CE2-CB 3.85Å; F1977-C2134 VanDerWaalsContact CE2-SG 3.51Å; F1977-C2134 WeakPolarHBondContact CG-SG 3.3Å; F1977-C2134 HydrophobicContact CZ-CB 4.45Å; F1977-E2236 VanDerWaalsContact CD1-CD 3.46Å; F1977-E2236 HydrophobicContact CD1-CG 3.85Å; F1977-E2236 WeakPolarHBondContact CD1-OE1 3.47Å; F1977-E2236 HydrophobicContact CE1-CG 4.08Å; F1977-E2236 PolarHBondContact N-OE1 2.77Å
1978	N	66.3	Low	68.9	Low	30 Å²	30	55.7 Å²	55.7	16%	0.16	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139	51.6	-171.6	57.1	13.2	0	0	0	112.4	P1976 E1980 R2129	P1976-N1978 PolarHBondContact O-N 3.31Å; N1978-E1980 VanDerWaalsContact C-N 3.34Å; N1978-R2129 PolarHBondContact ND2-O 3.38Å; N1978-R2129 WeakPolarHBondContact OD1-CD 3.42Å; N1978-R2129 PolarHBondContact OD1-NE 3.02Å
1979	F	58.6	Low	69.1	Low	50 Å²	50	50.8 Å²	50.8	22%	0.219	26%	0.263	C	S	.	.			trans	-77.9	-14.4	174.8	-166.6	-102.8	0	0	0	113.6	K1957 K1981 E2011	K1957-F1979 WeakPolarHBondContact O-CE2 3.41Å; F1979-K1981 PolarHBondContact O-N 2.8Å; F1979-E2011 HydrophobicContact CD1-CG 4.48Å; F1979-E2011 WeakPolarHBondContact CD1-OE2 3.43Å; F1979-E2011 HydrophobicContact CE1-CB 3.85Å; F1979-E2011 HydrophobicContact CE1-CG 3.75Å; F1979-E2011 WeakPolarHBondContact CE1-OE2 3.47Å; F1979-E2011 HydrophobicContact CZ-CG 4.41Å
1980	E	58.8	Low	69.1	Low	38 Å²	38	52 Å²	52	18%	0.178	27%	0.273	C	S	.	.			trans	-64.1	92	-179.2	-60	156.8	-152.4	0	0	111.8	N1978 L2087 Q2196 L2197 R2250	N1978-E1980 VanDerWaalsContact C-N 3.34Å; E1980-L2087 HydrophobicContact CG-CD1 4.5Å; E1980-Q2196 WeakPolarHBondContact OE2-CB 3.32Å; E1980-L2197 HydrophobicContact CG-CD2 3.86Å; E1980-L2197 WeakPolarHBondContact OE1-CD2 3.41Å; E1980-L2197 WeakPolarHBondContact OE1-CG 3.46Å; E1980-R2250 IonicContact OE1-CZ 2.71Å; E1980-R2250 IonicContact OE1-NH1 3.31Å; E1980-R2250 PolarHBondContact OE1-NH1 3.29Å; E1980-R2250 IonicContact OE1-NH2 3.04Å; E1980-R2250 PolarHBondContact OE1-NH2 3.5Å; E1980-R2250 IonicContact OE2-NH2 2.77Å
1981	K	52.5	Low	69	Low	165 Å²	165	54.9 Å²	54.9	72%	0.717	30%	0.297	S	S	*	.			trans	-116.5	42.8	-171.2	-150.2	-165.3	179.4	-167.9	0	114.8	F1979	F1979-K1981 PolarHBondContact O-N 2.8Å
1982	Y	48.8	Very low	68.9	Low	144 Å²	144	62.2 Å²	62.2	57%	0.565	33%	0.331	S	S	*	.			trans	-148.6	94.1	166.4	-68.7	-78.8	0	0	0	113.1	G1984 M1985	Y1982-G1984 PolarHBondContact O-N 3.38Å; Y1982-M1985 HydrophobicContact CD2-SD 4.39Å; Y1982-M1985 HydrophobicContact CG-SD 4.19Å
1983	P	48.1	Very low	68.9	Low	139 Å²	139	66.7 Å²	66.7	90%	0.903	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	114.1	156	29.2	-26.3	0	0	0	107.2
1984	G	52.1	Low	68.9	Low	70 Å²	70	70.4 Å²	70.4	72%	0.722	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	123.5	1.3	178.6	0	0	0	0	0	116.5	Y1982	Y1982-G1984 PolarHBondContact O-N 3.38Å
1985	M	60.2	Low	69.1	Low	55 Å²	55	71.4 Å²	71.4	27%	0.271	38%	0.378	S	S	.	.			trans	-101.7	24.1	174.8	-114	176.2	72	0	0	113.6	Y1982 Y2006 A2008	Y1982-M1985 HydrophobicContact CD2-SD 4.39Å; Y1982-M1985 HydrophobicContact CG-SD 4.19Å; M1985-Y2006 WeakPolarHBondContact O-CB 3.44Å; M1985-A2008 HydrophobicContact CE-CB 4.06Å
1986	R	71.3	Confident	69.7	Low	80 Å²	80	74.5 Å²	74.5	30%	0.302	39%	0.39	S	S	.	.	S	Bend	trans	-105.3	148.9	164.7	-74.2	178.5	-179.1	-88.7	-3.4	108.1	T2080 L2082 Q2196 N2198	R1986-T2080 PolarHBondContact NH1-O 2.85Å; R1986-L2082 HydrophobicContact CG-CD1 3.59Å; R1986-L2082 HydrophobicContact CG-CG 4.03Å; R1986-L2082 VanDerWaalsContact CZ-CD1 3.42Å; R1986-Q2196 PolarHBondContact NH2-O 3.36Å; R1986-N2198 PolarHBondContact NH1-O 2.87Å; R1986-N2198 PolarHBondContact NH2-O 2.9Å
1987	M	77.1	Confident	70.6	Confident	17 Å²	17	78.8 Å²	78.8	8%	0.084	42%	0.416	C	S	.	.			trans	-68.5	130.1	158.5	-170.1	-155.4	-174.7	0	0	107.8	V1989 Y2000 D2002 Y2003 F2004 Y2006 G2081	M1987-V1989 WeakPolarHBondContact O-CG2 3.36Å; M1987-V1989 PolarHBondContact O-N 3.01Å; M1987-Y2000 HydrophobicContact CE-CE1 3.81Å; M1987-Y2000 HydrophobicContact CE-CE2 4.28Å; M1987-Y2000 VanDerWaalsContact CE-OH 3.25Å; M1987-Y2000 WeakPolarHBondContact CE-OH 3.36Å; M1987-Y2000 HydrophobicContact SD-CE1 4.26Å; M1987-D2002 WeakPolarHBondContact CE-O 3.35Å; M1987-Y2003 HydrophobicContact CE-CD2 4.16Å; M1987-Y2003 HydrophobicContact SD-CD2 3.17Å; M1987-Y2003 WeakPolarHBondContact SD-CD2 3.47Å; M1987-Y2003 HydrophobicContact SD-CE2 3.45Å; M1987-Y2003 WeakPolarHBondContact SD-CE2 3.35Å; M1987-Y2003 HydrophobicContact SD-CG 4.06Å; M1987-F2004 WeakPolarHBondContact CB-O 3.47Å; M1987-F2004 HydrophobicContact CE-CD1 3.9Å; M1987-F2004 HydrophobicContact CE-CE1 3.98Å; M1987-F2004 HydrophobicContact CG-CE1 4.43Å; M1987-F2004 HydrophobicContact CG-CZ 4.44Å; M1987-F2004 VanDerWaalsContact CG-O 3.24Å; M1987-F2004 WeakPolarHBondContact CG-O 3.44Å; M1987-F2004 HydrophobicContact SD-CD1 4.46Å; M1987-F2004 PolarHBondContact SD-N 3.3Å; M1987-F2004 VanDerWaalsContact SD-N 3.41Å; M1987-Y2006 HydrophobicContact CB-CD2 4.49Å; M1987-G2081 PolarHBondContact N-O 2.91Å; M1987-G2081 VanDerWaalsContact N-O 3.13Å
1988	N	76.5	Confident	71.2	Confident	124 Å²	124	81 Å²	81	66%	0.663	43%	0.43	S	S	*	.			trans	-65.8	116.3	170.3	-89.6	-0.5	0	0	0	108.5
1989	V	79.1	Confident	71.9	Confident	27 Å²	27	87.6 Å²	87.6	16%	0.164	46%	0.46	C	S	.	.			trans	-105.2	110.6	177.2	-172.1	0	0	0	0	107.7	M1987 M1994 Y2000 Y2003 R2079	M1987-V1989 WeakPolarHBondContact O-CG2 3.36Å; M1987-V1989 PolarHBondContact O-N 3.01Å; V1989-M1994 HydrophobicContact CG1-CG 4.06Å; V1989-Y2000 HydrophobicContact CG1-CE1 4.45Å; V1989-Y2003 HydrophobicContact CG2-CD2 4.43Å; V1989-Y2003 HydrophobicContact CG2-CE2 3.66Å; V1989-R2079 HydrophobicContact CG1-CB 3.93Å; V1989-R2079 HydrophobicContact CG2-CB 4.26Å
1990	P	78.3	Confident	73.1	Confident	48 Å²	48	87 Å²	87	31%	0.312	46%	0.456	S	S	.	.			trans	-54.8	145.2	177	-26.6	34.4	0	0	0	111.5	E1992 R1993 M1994	P1990-E1992 PolarHBondContact O-N 2.99Å; P1990-E1992 VanDerWaalsContact O-N 3.1Å; P1990-R1993 CarbonylContact O-C 2.87Å; P1990-R1993 WeakPolarHBondContact O-CA 3.28Å; P1990-R1993 PolarHBondContact O-N 2.73Å; P1990-M1994 PolarHBondContact O-N 3.42Å; P1990-M1994 VanDerWaalsContact O-N 3.09Å
1991	P	79.6	Confident	74.1	Confident	100 Å²	100	89.9 Å²	89.9	65%	0.649	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-53.2	-36.7	-177.5	-27.8	34.5	0	0	0	113.9	R1993 M1994	P1991-R1993 VanDerWaalsContact C-N 3.3Å; P1991-R1993 PolarHBondContact O-N 3.14Å; P1991-M1994 HydrophobicContact CB-CE 3.88Å; P1991-M1994 PolarHBondContact O-N 3.24Å
1992	E	80.7	Confident	75.3	Confident	157 Å²	157	87.7 Å²	87.7	73%	0.734	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-68.8	-26.6	178.5	-55.5	-176.6	177.5	0	0	113	P1990 V1998	P1990-E1992 PolarHBondContact O-N 2.99Å; P1990-E1992 VanDerWaalsContact O-N 3.1Å; E1992-V1998 WeakPolarHBondContact O-CG2 3.42Å
1993	R	83.5	Confident	76.8	Confident	98 Å²	98	83.1 Å²	83.1	37%	0.37	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-103	2.3	-178.8	-58.9	-166.9	-174.5	-175.6	1.8	113.6	P1990 P1991 V1998 Y2000 R2079	P1990-R1993 CarbonylContact O-C 2.87Å; P1990-R1993 WeakPolarHBondContact O-CA 3.28Å; P1990-R1993 PolarHBondContact O-N 2.73Å; P1991-R1993 VanDerWaalsContact C-N 3.3Å; P1991-R1993 PolarHBondContact O-N 3.14Å; R1993-V1998 HydrophobicContact CG-CG1 4.27Å; R1993-Y2000 HydrophobicContact CB-CD1 3.81Å; R1993-Y2000 HydrophobicContact CB-CE1 4.26Å; R1993-Y2000 HydrophobicContact CB-CG 4.22Å; R1993-Y2000 HydrophobicContact CG-CD1 4.5Å; R1993-R2079 PolarHBondContact O-NH1 3.22Å
1994	M	84.1	Confident	78.3	Confident	88 Å²	88	82 Å²	82	43%	0.433	44%	0.438	S	S	.	.			trans	-60.1	-46.2	174.7	-76.3	-165.3	-73.2	0	0	111.5	V1989 P1990 P1991 W1996 G2078 R2079	V1989-M1994 HydrophobicContact CG1-CG 4.06Å; P1990-M1994 PolarHBondContact O-N 3.42Å; P1990-M1994 VanDerWaalsContact O-N 3.09Å; P1991-M1994 HydrophobicContact CB-CE 3.88Å; P1991-M1994 PolarHBondContact O-N 3.24Å; M1994-W1996 PolarHBondContact O-N 2.98Å; M1994-G2078 CarbonylContact O-C 3.37Å; M1994-G2078 WeakPolarHBondContact O-CA 3.45Å; M1994-R2079 PolarHBondContact O-N 2.92Å
1995	A	85.4	Confident	79.3	Confident	40 Å²	40	79.6 Å²	79.6	33%	0.331	41%	0.411	S	S	.	.	S	Bend	trans	-65.8	129.7	-176.3	0	0	0	0	0	111.4	T1997 V1998 R2079	A1995-T1997 WeakPolarHBondContact CB-OG1 3.32Å; A1995-T1997 PolarHBondContact O-N 3.38Å; A1995-V1998 HydrophobicContact CB-CG2 4.44Å; A1995-V1998 PolarHBondContact O-N 3.16Å; A1995-R2079 PolarHBondContact O-NH1 3.32Å
1996	W	85.6	Confident	79.7	Confident	66 Å²	66	81.9 Å²	81.9	25%	0.25	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-16.7	175.5	-65.8	108.8	0	0	0	113.8	M1994 V1998 L2074 N2075 G2078 R2079 D2200	M1994-W1996 PolarHBondContact O-N 2.98Å; W1996-V1998 VanDerWaalsContact C-N 3.34Å; W1996-L2074 HydrophobicContact CD2-CD1 4.47Å; W1996-L2074 HydrophobicContact CD2-CD2 4.26Å; W1996-L2074 HydrophobicContact CE3-CD2 4.26Å; W1996-L2074 HydrophobicContact CH2-CD2 3.81Å; W1996-L2074 HydrophobicContact CZ2-CD2 3.79Å; W1996-L2074 HydrophobicContact CZ3-CD2 4.04Å; W1996-N2075 VanDerWaalsContact CD1-O 3.27Å; W1996-N2075 PolarHBondContact NE1-O 2.66Å; W1996-G2078 VanDerWaalsContact NE1-C 3.34Å; W1996-G2078 PolarHBondContact NE1-O 3.44Å; W1996-R2079 HydrophobicContact CD2-CG 3.98Å; W1996-R2079 HydrophobicContact CE3-CG 3.62Å; W1996-R2079 HydrophobicContact CH2-CB 4.42Å; W1996-R2079 HydrophobicContact CH2-CG 3.55Å; W1996-R2079 HydrophobicContact CZ2-CB 4.49Å; W1996-R2079 HydrophobicContact CZ2-CG 3.9Å; W1996-R2079 HydrophobicContact CZ3-CG 3.4Å; W1996-R2079 VanDerWaalsContact CZ3-CG 3.4Å; W1996-D2200 HydrophobicContact CH2-CB 4.11Å; W1996-D2200 HydrophobicContact CZ2-CB 4.12Å
1997	T	84.4	Confident	79.4	Confident	107 Å²	107	80.4 Å²	80.4	66%	0.656	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-19.1	175.5	48.8	0	0	0	0	113.9	A1995	A1995-T1997 WeakPolarHBondContact CB-OG1 3.32Å; A1995-T1997 PolarHBondContact O-N 3.38Å
1998	V	84.4	Confident	78.6	Confident	58 Å²	58	80.5 Å²	80.5	35%	0.352	42%	0.419	S	S	.	.	S	Bend	trans	-93.6	131.7	176.7	-178.8	0	0	0	0	108.8	E1992 R1993 A1995 W1996 R2079	E1992-V1998 WeakPolarHBondContact O-CG2 3.42Å; R1993-V1998 HydrophobicContact CG-CG1 4.27Å; A1995-V1998 HydrophobicContact CB-CG2 4.44Å; A1995-V1998 PolarHBondContact O-N 3.16Å; W1996-V1998 VanDerWaalsContact C-N 3.34Å; V1998-R2079 PolarHBondContact O-NH1 3.13Å; V1998-R2079 PolarHBondContact O-NH2 3.43Å
1999	E	81.6	Confident	77.4	Confident	168 Å²	168	76.9 Å²	76.9	79%	0.785	40%	0.403	S	S	*	.			trans	-73.2	129.1	179.8	-162.5	169.1	-167.7	0	0	109.9	P2001	E1999-P2001 HydrophobicContact CG-CG 4.41Å
2000	Y	83.4	Confident	76.2	Confident	37 Å²	37	83.2 Å²	83.2	15%	0.145	43%	0.431	C	S	.	.			trans	-134.5	82.4	178.1	-168.3	-178.4	0	0	0	108.8	M1987 V1989 R1993 D2002 Y2003	M1987-Y2000 HydrophobicContact CE-CE1 3.81Å; M1987-Y2000 HydrophobicContact CE-CE2 4.28Å; M1987-Y2000 VanDerWaalsContact CE-OH 3.25Å; M1987-Y2000 WeakPolarHBondContact CE-OH 3.36Å; M1987-Y2000 HydrophobicContact SD-CE1 4.26Å; V1989-Y2000 HydrophobicContact CG1-CE1 4.45Å; R1993-Y2000 HydrophobicContact CB-CD1 3.81Å; R1993-Y2000 HydrophobicContact CB-CE1 4.26Å; R1993-Y2000 HydrophobicContact CB-CG 4.22Å; R1993-Y2000 HydrophobicContact CG-CD1 4.5Å; Y2000-D2002 HydrophobicContact CE2-CB 4.25Å; Y2000-D2002 PolarHBondContact O-N 2.89Å; Y2000-Y2003 AromaticContact CD1-CD2 3.67Å; Y2000-Y2003 HydrophobicContact CD1-CD2 3.67Å; Y2000-Y2003 HydrophobicContact CD1-CG 4.15Å; Y2000-Y2003 AromaticContact CE1-CD2 3.88Å; Y2000-Y2003 HydrophobicContact CE1-CD2 3.88Å; Y2000-Y2003 VanDerWaalsContact O-CB 3.22Å; Y2000-Y2003 WeakPolarHBondContact O-CB 3.27Å; Y2000-Y2003 PolarHBondContact O-N 2.99Å; Y2000-Y2003 VanDerWaalsContact O-N 3.12Å
2001	P	79.4	Confident	75.2	Confident	100 Å²	100	83 Å²	83	65%	0.649	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.1	-172.2	-24.9	34.2	0	0	0	113.8	E1999 Y2003	E1999-P2001 HydrophobicContact CG-CG 4.41Å; P2001-Y2003 VanDerWaalsContact C-N 3.31Å; P2001-Y2003 PolarHBondContact O-N 3.36Å
2002	D	76.9	Confident	74.1	Confident	119 Å²	119	84 Å²	84	64%	0.636	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	13.2	-177.9	-46.3	-49.3	0	0	0	113.1	M1987 Y2000 F2004	M1987-D2002 WeakPolarHBondContact CE-O 3.35Å; Y2000-D2002 HydrophobicContact CE2-CB 4.25Å; Y2000-D2002 PolarHBondContact O-N 2.89Å; D2002-F2004 WeakPolarHBondContact O-CD1 3.42Å; D2002-F2004 PolarHBondContact O-N 2.9Å
2003	Y	81.6	Confident	73.5	Confident	48 Å²	48	77.4 Å²	77.4	19%	0.188	39%	0.394	C	S	.	.			trans	-67.9	118.1	179.8	-175.4	-108.2	0	0	0	112	M1987 V1989 Y2000 P2001 A2005 R2079 G2081 D2200	M1987-Y2003 HydrophobicContact CE-CD2 4.16Å; M1987-Y2003 HydrophobicContact SD-CD2 3.17Å; M1987-Y2003 WeakPolarHBondContact SD-CD2 3.47Å; M1987-Y2003 HydrophobicContact SD-CE2 3.45Å; M1987-Y2003 WeakPolarHBondContact SD-CE2 3.35Å; M1987-Y2003 HydrophobicContact SD-CG 4.06Å; V1989-Y2003 HydrophobicContact CG2-CD2 4.43Å; V1989-Y2003 HydrophobicContact CG2-CE2 3.66Å; Y2000-Y2003 AromaticContact CD1-CD2 3.67Å; Y2000-Y2003 HydrophobicContact CD1-CD2 3.67Å; Y2000-Y2003 HydrophobicContact CD1-CG 4.15Å; Y2000-Y2003 AromaticContact CE1-CD2 3.88Å; Y2000-Y2003 HydrophobicContact CE1-CD2 3.88Å; Y2000-Y2003 VanDerWaalsContact O-CB 3.22Å; Y2000-Y2003 WeakPolarHBondContact O-CB 3.27Å; Y2000-Y2003 PolarHBondContact O-N 2.99Å; Y2000-Y2003 VanDerWaalsContact O-N 3.12Å; P2001-Y2003 VanDerWaalsContact C-N 3.31Å; P2001-Y2003 PolarHBondContact O-N 3.36Å; Y2003-A2005 HydrophobicContact CE1-CB 4.11Å; Y2003-R2079 HydrophobicContact CD2-CG 4.49Å; Y2003-R2079 HydrophobicContact CE1-CB 4.48Å; Y2003-R2079 HydrophobicContact CE1-CG 4.06Å; Y2003-R2079 HydrophobicContact CE2-CB 3.84Å; Y2003-R2079 HydrophobicContact CE2-CG 4.09Å; Y2003-G2081 WeakPolarHBondContact OH-CA 3.18Å; Y2003-G2081 PolarHBondContact OH-N 3.05Å; Y2003-D2200 WeakPolarHBondContact CE1-OD2 3.44Å; Y2003-D2200 PolarHBondContact OH-OD1 3.37Å; Y2003-D2200 VanDerWaalsContact OH-OD1 3.1Å; Y2003-D2200 PolarHBondContact OH-OD2 3.46Å
2004	F	78.8	Confident	72.9	Confident	115 Å²	115	75.5 Å²	75.5	50%	0.504	39%	0.391	S	S	.	.			trans	-129.8	126.4	170.3	67.8	-86.2	0	0	0	109.4	M1987 D2002 Y2006	M1987-F2004 WeakPolarHBondContact CB-O 3.47Å; M1987-F2004 HydrophobicContact CE-CD1 3.9Å; M1987-F2004 HydrophobicContact CE-CE1 3.98Å; M1987-F2004 HydrophobicContact CG-CE1 4.43Å; M1987-F2004 HydrophobicContact CG-CZ 4.44Å; M1987-F2004 VanDerWaalsContact CG-O 3.24Å; M1987-F2004 WeakPolarHBondContact CG-O 3.44Å; M1987-F2004 HydrophobicContact SD-CD1 4.46Å; M1987-F2004 PolarHBondContact SD-N 3.3Å; M1987-F2004 VanDerWaalsContact SD-N 3.41Å; D2002-F2004 WeakPolarHBondContact O-CD1 3.42Å; D2002-F2004 PolarHBondContact O-N 2.9Å; F2004-Y2006 HydrophobicContact CE2-CE1 4.28Å; F2004-Y2006 AromaticContact CE2-CE2 3.93Å; F2004-Y2006 HydrophobicContact CE2-CE2 3.93Å; F2004-Y2006 AromaticContact CE2-CZ 3.72Å
2005	A	72.5	Confident	72.5	Confident	19 Å²	19	74.2 Å²	74.2	16%	0.157	38%	0.383	C	S	.	.			trans	-100.5	139.8	179.3	0	0	0	0	0	110.7	Y2003 L2083	Y2003-A2005 HydrophobicContact CE1-CB 4.11Å; A2005-L2083 HydrophobicContact CB-CB 3.86Å; A2005-L2083 HydrophobicContact CB-CD1 4.05Å
2006	Y	69.7	Low	71.8	Confident	103 Å²	103	73.7 Å²	73.7	40%	0.404	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	142.3	178.6	-72.3	-80.9	0	0	0	111.3	M1985 M1987 F2004 G2081 L2083	M1985-Y2006 WeakPolarHBondContact O-CB 3.44Å; M1987-Y2006 HydrophobicContact CB-CD2 4.49Å; F2004-Y2006 HydrophobicContact CE2-CE1 4.28Å; F2004-Y2006 AromaticContact CE2-CE2 3.93Å; F2004-Y2006 HydrophobicContact CE2-CE2 3.93Å; F2004-Y2006 AromaticContact CE2-CZ 3.72Å; Y2006-G2081 PolarHBondContact N-O 2.65Å; Y2006-G2081 VanDerWaalsContact N-O 3.12Å; Y2006-L2083 PolarHBondContact O-N 2.91Å
2007	D	65.2	Low	71.1	Confident	50 Å²	50	73 Å²	73	27%	0.267	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	105.4	173.2	-170.7	9.6	0	0	0	110.1	C2009 N2025 T2027	D2007-C2009 VanDerWaalsContact CG-SG 3.59Å; D2007-C2009 PolarHBondContact O-N 2.75Å; D2007-C2009 PolarHBondContact OD1-SG 3.38Å; D2007-N2025 VanDerWaalsContact OD1-CB 3.3Å; D2007-N2025 WeakPolarHBondContact OD1-CB 3.41Å; D2007-N2025 PolarHBondContact OD1-ND2 3Å; D2007-T2027 WeakPolarHBondContact OD2-CG2 3.29Å
2008	A	59.5	Low	70.3	Confident	19 Å²	19	76.2 Å²	76.2	16%	0.157	39%	0.389	C	S	.	.			trans	-79.9	43.8	-177.6	0	0	0	0	0	114.2	M1985 E2010 L2082	M1985-A2008 HydrophobicContact CE-CB 4.06Å; A2008-E2010 PolarHBondContact O-N 3.49Å; A2008-L2082 HydrophobicContact CB-CD2 3.37Å
2009	C	52.5	Low	69.6	Low	47 Å²	47	79 Å²	79	32%	0.318	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.4	-174.6	-84.9	0	0	0	0	116	D2007 E2011 N2025 T2027	D2007-C2009 VanDerWaalsContact CG-SG 3.59Å; D2007-C2009 PolarHBondContact O-N 2.75Å; D2007-C2009 PolarHBondContact OD1-SG 3.38Å; C2009-E2011 PolarHBondContact O-N 3.27Å; C2009-N2025 PolarHBondContact SG-ND2 2.81Å; C2009-T2027 HydrophobicContact CB-CG2 4.2Å; C2009-T2027 VanDerWaalsContact SG-CG2 3.57Å
2010	E	53.6	Low	69.1	Low	160 Å²	160	71 Å²	71	75%	0.748	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-20.4	-175.8	-67.5	-167.9	167.7	0	0	114.2	A2008	A2008-E2010 PolarHBondContact O-N 3.49Å
2011	E	56	Low	68.7	Low	43 Å²	43	71.9 Å²	71.9	20%	0.201	37%	0.366	C	S	.	.	S	Bend	trans	-93.8	107	-177.5	-90.8	-173.4	-166.7	0	0	112.1	F1979 C2009 L2013 L2087	F1979-E2011 HydrophobicContact CD1-CG 4.48Å; F1979-E2011 WeakPolarHBondContact CD1-OE2 3.43Å; F1979-E2011 HydrophobicContact CE1-CB 3.85Å; F1979-E2011 HydrophobicContact CE1-CG 3.75Å; F1979-E2011 WeakPolarHBondContact CE1-OE2 3.47Å; F1979-E2011 HydrophobicContact CZ-CG 4.41Å; C2009-E2011 PolarHBondContact O-N 3.27Å; E2011-L2013 PolarHBondContact O-N 2.93Å; E2011-L2087 HydrophobicContact CB-CD2 3.9Å
2012	I	57.7	Low	68.5	Low	123 Å²	123	68.2 Å²	68.2	63%	0.631	34%	0.341	S	S	*	.			trans	-85.2	101.6	-178.3	-54.2	172.5	0	0	0	110.2
2013	L	68.6	Low	68.1	Low	17 Å²	17	64.5 Å²	64.5	9%	0.089	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-78	126.1	160.7	-96.8	138.8	0	0	0	109.9	V1961 M1974 E2011 F2015 L2087	V1961-L2013 HydrophobicContact CG2-CD2 3.55Å; M1974-L2013 HydrophobicContact CE-CD1 3.33Å; M1974-L2013 HydrophobicContact CE-CD2 3.76Å; M1974-L2013 HydrophobicContact CE-CG 4.21Å; E2011-L2013 PolarHBondContact O-N 2.93Å; L2013-F2015 HydrophobicContact CB-CE2 4.14Å; L2013-F2015 HydrophobicContact CB-CZ 4.23Å; L2013-F2015 WeakPolarHBondContact O-CD2 3.44Å; L2013-F2015 PolarHBondContact O-N 2.86Å; L2013-L2087 HydrophobicContact CD1-CB 3.84Å; L2013-L2087 HydrophobicContact CD1-CD2 3.71Å; L2013-L2087 HydrophobicContact CD1-CG 4.26Å
2014	L	70.3	Confident	66.9	Low	59 Å²	59	67 Å²	67	31%	0.309	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-81.3	116.1	174	-68.9	168	0	0	0	109.8	P1951 V1953 G1959 V1961	P1951-L2014 HydrophobicContact CB-CB 3.98Å; P1951-L2014 HydrophobicContact CG-CB 4.38Å; V1953-L2014 HydrophobicContact CG1-CD1 4.11Å; V1953-L2014 HydrophobicContact CG2-CD1 3.97Å; G1959-L2014 PolarHBondContact O-N 3.21Å; V1961-L2014 PolarHBondContact N-O 3.38Å; V1961-L2014 VanDerWaalsContact N-O 3.1Å
2015	F	74.7	Confident	65.7	Low	60 Å²	60	62 Å²	62	26%	0.263	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-94.9	152	174.3	-65.1	-79.7	0	0	0	111.5	V1961 L2013 S2020 H2021 P2089	V1961-F2015 HydrophobicContact CB-CD1 4.27Å; V1961-F2015 HydrophobicContact CG2-CD1 3.81Å; V1961-F2015 HydrophobicContact CG2-CE1 3.78Å; L2013-F2015 HydrophobicContact CB-CE2 4.14Å; L2013-F2015 HydrophobicContact CB-CZ 4.23Å; L2013-F2015 WeakPolarHBondContact O-CD2 3.44Å; L2013-F2015 PolarHBondContact O-N 2.86Å; F2015-S2020 WeakPolarHBondContact CB-OG 3.36Å; F2015-H2021 HydrophobicContact CD1-CB 4.48Å; F2015-H2021 HydrophobicContact CD2-CB 4.28Å; F2015-H2021 HydrophobicContact CE2-CB 4.32Å; F2015-H2021 HydrophobicContact CG-CB 4.37Å; F2015-H2021 HydrophobicContact CZ-CB 4.46Å; F2015-P2089 HydrophobicContact CE1-CB 3.88Å; F2015-P2089 HydrophobicContact CZ-CB 4.44Å
2016	P	72.2	Confident	64.6	Low	30 Å²	30	62.8 Å²	62.8	20%	0.195	33%	0.329	C	S	.	.	S	Bend	trans	-72.8	-25.9	-175	-17.4	31.1	0	0	0	115.8	L1949 P1951 E1963 W1972	L1949-P2016 HydrophobicContact CB-CB 4.14Å; L1949-P2016 HydrophobicContact CD2-CB 3.72Å; L1949-P2016 HydrophobicContact CG-CB 4.49Å; P1951-P2016 HydrophobicContact CG-CG 4.33Å; E1963-P2016 HydrophobicContact CB-CG 3.93Å; W1972-P2016 HydrophobicContact CZ3-CG 4.11Å
2017	S	71.2	Confident	63.4	Low	50 Å²	50	61.7 Å²	61.7	35%	0.35	33%	0.333	S	S	.	.	S	Bend	trans	-156.2	157.1	-178.9	60.9	0	0	0	0	112.2	E2019 S2020	S2017-E2019 PolarHBondContact O-N 2.92Å; S2017-E2019 VanDerWaalsContact O-N 3.17Å; S2017-S2020 PolarHBondContact N-OG 3.35Å; S2017-S2020 WeakPolarHBondContact O-CB 3.43Å; S2017-S2020 PolarHBondContact O-N 3.29Å; S2017-S2020 PolarHBondContact O-OG 3.5Å
2018	E	67.6	Low	62.1	Low	176 Å²	176	65.7 Å²	65.7	82%	0.822	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-61.5	-24	177.4	-73.5	-172.2	160.7	0	0	113.5	S2020	E2018-S2020 PolarHBondContact O-N 3.01Å
2019	E	69.7	Low	60.9	Low	116 Å²	116	68.4 Å²	68.4	54%	0.542	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-76.8	-11	176.5	-56.2	-169.9	147.8	0	0	113.5	S2017 K2054 R2090	S2017-E2019 PolarHBondContact O-N 2.92Å; S2017-E2019 VanDerWaalsContact O-N 3.17Å; E2019-K2054 IonicContact OE1-NZ 2.72Å; E2019-K2054 PolarHBondContact OE1-NZ 3.42Å; E2019-K2054 IonicContact OE2-NZ 2.72Å; E2019-K2054 PolarHBondContact OE2-NZ 2.89Å; E2019-R2090 PolarHBondContact O-NH1 2.79Å; E2019-R2090 VanDerWaalsContact O-NH1 3.14Å; E2019-R2090 PolarHBondContact O-NH2 2.88Å
2020	S	70.4	Confident	59.9	Low	0 Å²	0	72.2 Å²	72.2	0%	0	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-82.6	-10.9	-175.3	65.6	0	0	0	0	114.3	F2015 S2017 E2018 R2090	F2015-S2020 WeakPolarHBondContact CB-OG 3.36Å; S2017-S2020 PolarHBondContact N-OG 3.35Å; S2017-S2020 WeakPolarHBondContact O-CB 3.43Å; S2017-S2020 PolarHBondContact O-N 3.29Å; S2017-S2020 PolarHBondContact O-OG 3.5Å; E2018-S2020 PolarHBondContact O-N 3.01Å; S2020-R2090 VanDerWaalsContact O-CZ 3.28Å; S2020-R2090 PolarHBondContact O-NH2 3.28Å
2021	H	74.5	Confident	58.8	Low	55 Å²	55	72.9 Å²	72.9	26%	0.255	40%	0.404	S	S	.	.	S	Bend	trans	-136.3	160.3	177	68.6	85	0	0	0	111.7	F2015 G2023 P2089	F2015-H2021 HydrophobicContact CD1-CB 4.48Å; F2015-H2021 HydrophobicContact CD2-CB 4.28Å; F2015-H2021 HydrophobicContact CE2-CB 4.32Å; F2015-H2021 HydrophobicContact CG-CB 4.37Å; F2015-H2021 HydrophobicContact CZ-CB 4.46Å; H2021-G2023 WeakPolarHBondContact ND1-CA 3.4Å; H2021-G2023 PolarHBondContact ND1-N 3.35Å; H2021-G2023 VanDerWaalsContact ND1-N 3.13Å; H2021-G2023 PolarHBondContact ND1-O 3.25Å; H2021-G2023 PolarHBondContact O-N 3.49Å; H2021-P2089 WeakPolarHBondContact CA-O 3.33Å
2022	D	76.3	Confident	57.6	Low	23 Å²	23	76.4 Å²	76.4	12%	0.123	43%	0.428	C	S	.	.			trans	-96.9	53.1	-178.5	-54.9	-24.1	0	0	0	112.6	R2057 K2085 P2089 R2090 W2091	D2022-R2057 IonicContact OD1-NH2 2.95Å; D2022-R2057 PolarHBondContact OD1-NH2 2.7Å; D2022-R2057 IonicContact OD2-CZ 3.02Å; D2022-R2057 VanDerWaalsContact OD2-CZ 3.23Å; D2022-R2057 IonicContact OD2-NH1 3.2Å; D2022-R2057 PolarHBondContact OD2-NH1 2.84Å; D2022-R2057 IonicContact OD2-NH2 2.76Å; D2022-R2057 PolarHBondContact OD2-NH2 3.33Å; D2022-K2085 VanDerWaalsContact O-CE 3.3Å; D2022-K2085 WeakPolarHBondContact O-CE 3.33Å; D2022-K2085 PolarHBondContact O-NZ 2.9Å; D2022-P2089 PolarHBondContact N-O 2.92Å; D2022-R2090 WeakPolarHBondContact OD1-CD 3.45Å; D2022-R2090 IonicContact OD1-CZ 2.95Å; D2022-R2090 IonicContact OD1-NE 2.72Å; D2022-R2090 IonicContact OD1-NH1 3.24Å; D2022-R2090 PolarHBondContact OD1-NH1 3.12Å; D2022-R2090 WeakPolarHBondContact OD2-CA 3.45Å; D2022-R2090 WeakPolarHBondContact OD2-CD 3.33Å; D2022-W2091 HydrophobicContact CB-CG 4.28Å; D2022-W2091 PolarHBondContact O-NE1 3.21Å; D2022-W2091 PolarHBondContact OD2-N 2.83Å
2023	G	66.9	Low	56.5	Low	41 Å²	41	77 Å²	77	42%	0.423	43%	0.426	S	S	.	.			trans	66	-158	-171.6	0	0	0	0	0	113.6	H2021 K2085	H2021-G2023 WeakPolarHBondContact ND1-CA 3.4Å; H2021-G2023 PolarHBondContact ND1-N 3.35Å; H2021-G2023 VanDerWaalsContact ND1-N 3.13Å; H2021-G2023 PolarHBondContact ND1-O 3.25Å; H2021-G2023 PolarHBondContact O-N 3.49Å; G2023-K2085 VanDerWaalsContact C-NZ 3.3Å; G2023-K2085 PolarHBondContact O-NZ 3.2Å
2024	V	57.8	Low	54.9	Low	100 Å²	100	79.9 Å²	79.9	61%	0.606	45%	0.445	S	S	*	.			trans	-103.4	-156	-176.9	-147.7	0	0	0	0	111.2	K2085 W2091	V2024-K2085 PolarHBondContact O-NZ 3.07Å; V2024-W2091 WeakPolarHBondContact O-CZ2 3.29Å
2025	N	53.2	Low	53.2	Low	11 Å²	11	85.5 Å²	85.5	6%	0.059	47%	0.467	C	S	.	.			trans	-96.7	-170.8	174.9	-62	-19.3	0	0	0	111.4	D2007 C2009 T2027 K2085	D2007-N2025 VanDerWaalsContact OD1-CB 3.3Å; D2007-N2025 WeakPolarHBondContact OD1-CB 3.41Å; D2007-N2025 PolarHBondContact OD1-ND2 3Å; C2009-N2025 PolarHBondContact SG-ND2 2.81Å; N2025-T2027 VanDerWaalsContact C-N 3.28Å; N2025-T2027 PolarHBondContact O-N 2.96Å; N2025-T2027 VanDerWaalsContact O-N 3.11Å; N2025-K2085 PolarHBondContact OD1-N 3.39Å
2026	F	50.1	Low	51.6	Low	35 Å²	35	89.6 Å²	89.6	15%	0.154	49%	0.487	C	S	.	.			trans	-81.2	69.3	169.3	-79.8	-71.8	0	0	0	111.4	H2028 H2037 L2041 T2070 L2083	F2026-H2028 PolarHBondContact O-ND1 3.5Å; F2026-H2037 HydrophobicContact CD1-CB 4.48Å; F2026-H2037 HydrophobicContact CE1-CB 4.34Å; F2026-L2041 HydrophobicContact CD2-CD1 4.38Å; F2026-L2041 HydrophobicContact CE1-CD1 4.11Å; F2026-L2041 HydrophobicContact CE2-CD1 3.41Å; F2026-L2041 VanDerWaalsContact CE2-CD1 3.41Å; F2026-L2041 HydrophobicContact CZ-CD1 3.25Å; F2026-T2070 HydrophobicContact CD2-CG2 4.41Å; F2026-T2070 HydrophobicContact CE2-CG2 3.69Å; F2026-T2070 HydrophobicContact CZ-CG2 3.9Å; F2026-L2083 HydrophobicContact CB-CD2 4.4Å
2027	T	43.6	Very low	50.5	Low	80 Å²	80	93.1 Å²	93.1	49%	0.491	50%	0.501	S	S	.	.			trans	-66.1	146	174.6	51.3	0	0	0	0	111.5	D2007 C2009 N2025	D2007-T2027 WeakPolarHBondContact OD2-CG2 3.29Å; C2009-T2027 HydrophobicContact CB-CG2 4.2Å; C2009-T2027 VanDerWaalsContact SG-CG2 3.57Å; N2025-T2027 VanDerWaalsContact C-N 3.28Å; N2025-T2027 PolarHBondContact O-N 2.96Å; N2025-T2027 VanDerWaalsContact O-N 3.11Å
2028	H	36.9	Very low	49.5	Very low	135 Å²	135	92.2 Å²	92.2	63%	0.625	50%	0.495	S	S	*	.			trans	-131	-139.4	-172	-83.2	85.3	0	0	0	111.7	F2026 N2030 T2034	F2026-H2028 PolarHBondContact O-ND1 3.5Å; H2028-N2030 PolarHBondContact O-N 3.31Å; H2028-T2034 WeakPolarHBondContact NE2-CG2 3.45Å
2029	G	35.3	Very low	48.8	Very low	75 Å²	75	90.4 Å²	90.4	77%	0.773	49%	0.486	S	S	*	.	S	Bend	trans	86.9	-6.5	175.9	0	0	0	0	0	116.9
2030	N	31.5	Very low	48.5	Very low	127 Å²	127	89.7 Å²	89.7	68%	0.679	49%	0.486	S	S	*	.	S	Bend	trans	-139.1	118.1	171.5	-82.1	-40.3	0	0	0	111.4	H2028 V2032 F2033	H2028-N2030 PolarHBondContact O-N 3.31Å; N2030-V2032 PolarHBondContact O-N 2.98Å; N2030-F2033 HydrophobicContact CB-CD2 4.16Å; N2030-F2033 HydrophobicContact CB-CE2 4.04Å
2031	I	31	Very low	48.5	Very low	175 Å²	175	90.1 Å²	90.1	90%	0.897	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	103.9	173.5	-66.9	169.9	0	0	0	108.5
2032	V	30.4	Very low	48.2	Very low	116 Å²	116	95.3 Å²	95.3	70%	0.703	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	171	-40.5	155.6	143.5	0	0	0	0	111.8	N2030 T2034	N2030-V2032 PolarHBondContact O-N 2.98Å; V2032-T2034 PolarHBondContact O-N 3.39Å
2033	F	33.6	Very low	48.1	Very low	135 Å²	135	98.3 Å²	98.3	59%	0.592	53%	0.525	S	S	*	.			trans	-88.4	-4	-147.2	-60.1	-85.9	0	0	0	117.9	N2030 F2035	N2030-F2033 HydrophobicContact CB-CD2 4.16Å; N2030-F2033 HydrophobicContact CB-CE2 4.04Å; F2033-F2035 PolarHBondContact O-N 2.87Å
2034	T	36.9	Very low	48.7	Very low	79 Å²	79	97.8 Å²	97.8	49%	0.485	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-31.1	-159.1	54.9	0	0	0	0	115.8	H2028 V2032 Q2036 H2037	H2028-T2034 WeakPolarHBondContact NE2-CG2 3.45Å; V2032-T2034 PolarHBondContact O-N 3.39Å; T2034-Q2036 PolarHBondContact O-N 3.23Å; T2034-Q2036 VanDerWaalsContact O-N 3.1Å; T2034-H2037 PolarHBondContact O-N 3.18Å
2035	F	34.3	Very low	49.9	Very low	177 Å²	177	96.5 Å²	96.5	78%	0.776	50%	0.502	S	S	*	.	H	α-helix	trans	-60.6	-24.6	-174.6	-99.2	-85.3	0	0	0	114	F2033	F2033-F2035 PolarHBondContact O-N 2.87Å
2036	Q	39.8	Very low	51.4	Low	145 Å²	145	96.9 Å²	96.9	68%	0.678	50%	0.503	S	S	*	.	H	α-helix	trans	-79.5	-22.9	-176.8	-92	178.9	-29.5	0	0	115.1	T2034	T2034-Q2036 PolarHBondContact O-N 3.23Å; T2034-Q2036 VanDerWaalsContact O-N 3.1Å
2037	H	48.8	Very low	53.2	Low	105 Å²	105	96.6 Å²	96.6	49%	0.486	50%	0.503	S	S	.	.	H	α-helix	trans	-90.1	-25.3	-176.4	-87.3	62.3	0	0	0	113.7	F2026 T2034 E2039 N2040	F2026-H2037 HydrophobicContact CD1-CB 4.48Å; F2026-H2037 HydrophobicContact CE1-CB 4.34Å; T2034-H2037 PolarHBondContact O-N 3.18Å; H2037-E2039 VanDerWaalsContact C-N 3.3Å; H2037-E2039 PolarHBondContact O-N 3.49Å; H2037-N2040 PolarHBondContact O-N 3.2Å
2038	S	50.7	Low	55.1	Low	31 Å²	31	97.3 Å²	97.3	22%	0.217	50%	0.501	C	S	.	.	H	α-helix	trans	-70.9	-25.9	174.9	80.5	0	0	0	0	112.7
2039	E	54.1	Low	57.4	Low	138 Å²	138	95.1 Å²	95.1	65%	0.645	49%	0.487	S	S	*	.	H	α-helix	trans	-67.4	-36.5	174.9	-69.6	-161.2	157.7	0	0	112.2	H2037 R2042	H2037-E2039 VanDerWaalsContact C-N 3.3Å; H2037-E2039 PolarHBondContact O-N 3.49Å; E2039-R2042 PolarHBondContact O-N 3.49Å
2040	N	62.5	Low	59.6	Low	100 Å²	100	91.9 Å²	91.9	54%	0.535	45%	0.452	S	S	.	.	H	α-helix	trans	-67.4	-38.6	-178.5	-77.2	-29.1	0	0	0	113	H2037 T2043	H2037-N2040 PolarHBondContact O-N 3.2Å; N2040-T2043 PolarHBondContact O-N 3.09Å; N2040-T2043 PolarHBondContact O-OG1 2.92Å
2041	L	69.6	Low	61.9	Low	10 Å²	10	89.6 Å²	89.6	5%	0.052	45%	0.451	C	S	.	.	H	α-helix	trans	-66.7	-36.6	177.5	-91	143.5	0	0	0	112.7	F2026 T2043 I2044 F2046 A2072 W2091	F2026-L2041 HydrophobicContact CD2-CD1 4.38Å; F2026-L2041 HydrophobicContact CE1-CD1 4.11Å; F2026-L2041 HydrophobicContact CE2-CD1 3.41Å; F2026-L2041 VanDerWaalsContact CE2-CD1 3.41Å; F2026-L2041 HydrophobicContact CZ-CD1 3.25Å; L2041-T2043 PolarHBondContact O-N 3.09Å; L2041-I2044 PolarHBondContact O-N 3.01Å; L2041-F2046 HydrophobicContact CD2-CZ 4.15Å; L2041-A2072 HydrophobicContact CD2-CB 4.28Å; L2041-W2091 HydrophobicContact CD1-CH2 4.37Å; L2041-W2091 HydrophobicContact CD1-CZ2 4.18Å; L2041-W2091 HydrophobicContact CD2-CD2 3.87Å; L2041-W2091 HydrophobicContact CD2-CE3 4.23Å; L2041-W2091 HydrophobicContact CD2-CG 4.29Å; L2041-W2091 HydrophobicContact CD2-CH2 4.32Å; L2041-W2091 HydrophobicContact CD2-CZ2 3.98Å; L2041-W2091 HydrophobicContact CD2-CZ3 4.43Å; L2041-W2091 HydrophobicContact CG-CZ2 4.34Å
2042	R	70.1	Confident	64.1	Low	164 Å²	164	89.3 Å²	89.3	62%	0.619	44%	0.444	S	S	*	.	H	α-helix	trans	-68.6	-13	177.4	-67.4	-177.6	-178.1	-153.8	-0.5	113.6	E2039 T2069	E2039-R2042 PolarHBondContact O-N 3.49Å; R2042-T2069 PolarHBondContact NH2-O 2.88Å; R2042-T2069 VanDerWaalsContact NH2-O 3.16Å
2043	T	73.6	Confident	66.1	Low	86 Å²	86	85 Å²	85	53%	0.528	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-12.5	174.1	68.7	0	0	0	0	114.2	N2040 L2041	N2040-T2043 PolarHBondContact O-N 3.09Å; N2040-T2043 PolarHBondContact O-OG1 2.92Å; L2041-T2043 PolarHBondContact O-N 3.09Å
2044	I	78.2	Confident	68.2	Low	30 Å²	30	83.3 Å²	83.3	15%	0.154	41%	0.412	C	S	.	.	S	Bend	trans	-87.7	129.5	-177.4	-59.9	177.7	0	0	0	110.2	L2041 F2046 R2057	L2041-I2044 PolarHBondContact O-N 3.01Å; I2044-F2046 HydrophobicContact CB-CE1 4.42Å; I2044-F2046 HydrophobicContact CB-CE2 3.98Å; I2044-F2046 HydrophobicContact CB-CZ 3.89Å; I2044-F2046 HydrophobicContact CD1-CZ 4.47Å; I2044-F2046 HydrophobicContact CG2-CD1 4.23Å; I2044-F2046 HydrophobicContact CG2-CE1 3.82Å; I2044-F2046 HydrophobicContact CG2-CE2 4.21Å; I2044-F2046 HydrophobicContact CG2-CZ 3.81Å; I2044-F2046 WeakPolarHBondContact O-CD2 3.17Å; I2044-F2046 PolarHBondContact O-N 3.28Å; I2044-R2057 VanDerWaalsContact CG2-NE 3.27Å
2045	N	83.2	Confident	70.2	Confident	72 Å²	72	79.9 Å²	79.9	39%	0.385	39%	0.391	S	S	.	.			trans	-80.5	82.4	-179.4	-83.1	-27	0	0	0	112	Q2048	N2045-Q2048 HydrophobicContact CB-CG 3.79Å; N2045-Q2048 PolarHBondContact OD1-NE2 3.23Å; N2045-Q2048 VanDerWaalsContact OD1-NE2 3.09Å
2046	F	85.4	Confident	72.6	Confident	19 Å²	19	74 Å²	74	8%	0.083	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	157.2	175.4	-63.3	-66.2	0	0	0	113.5	L2041 I2044 Q2048 Y2064 L2066 G2071 P2073 W2091	L2041-F2046 HydrophobicContact CD2-CZ 4.15Å; I2044-F2046 HydrophobicContact CB-CE1 4.42Å; I2044-F2046 HydrophobicContact CB-CE2 3.98Å; I2044-F2046 HydrophobicContact CB-CZ 3.89Å; I2044-F2046 HydrophobicContact CD1-CZ 4.47Å; I2044-F2046 HydrophobicContact CG2-CD1 4.23Å; I2044-F2046 HydrophobicContact CG2-CE1 3.82Å; I2044-F2046 HydrophobicContact CG2-CE2 4.21Å; I2044-F2046 HydrophobicContact CG2-CZ 3.81Å; I2044-F2046 WeakPolarHBondContact O-CD2 3.17Å; I2044-F2046 PolarHBondContact O-N 3.28Å; F2046-Q2048 PolarHBondContact O-N 3.09Å; F2046-Y2064 HydrophobicContact CB-CE2 3.95Å; F2046-Y2064 HydrophobicContact CD1-CE2 4.29Å; F2046-Y2064 HydrophobicContact CG-CE2 4.41Å; F2046-L2066 HydrophobicContact CB-CD1 4.24Å; F2046-L2066 HydrophobicContact CB-CD2 3.75Å; F2046-L2066 HydrophobicContact CD2-CD1 4.32Å; F2046-L2066 HydrophobicContact CD2-CD2 3.88Å; F2046-L2066 HydrophobicContact CG-CD2 3.84Å; F2046-G2071 WeakPolarHBondContact CE2-O 3.5Å; F2046-P2073 HydrophobicContact CD1-CB 4.38Å; F2046-P2073 HydrophobicContact CD1-CG 4.27Å; F2046-P2073 HydrophobicContact CE1-CB 4.47Å; F2046-P2073 HydrophobicContact CE1-CG 3.89Å; F2046-P2073 HydrophobicContact CZ-CG 4.37Å; F2046-W2091 HydrophobicContact CE1-CB 3.75Å; F2046-W2091 HydrophobicContact CZ-CB 4.13Å
2047	N	87	Confident	74.8	Confident	30 Å²	30	67.2 Å²	67.2	16%	0.16	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	9.8	-176.2	-71.8	-55.2	0	0	0	115.9	Q2058 R2063 Y2064	N2047-Q2058 WeakPolarHBondContact O-CG 3.03Å; N2047-R2063 HydrophobicContact CB-CG 4.5Å; N2047-R2063 WeakPolarHBondContact OD1-CA 3.07Å; N2047-Y2064 PolarHBondContact N-OH 3.09Å; N2047-Y2064 PolarHBondContact ND2-O 3.07Å; N2047-Y2064 VanDerWaalsContact OD1-CD1 3.28Å; N2047-Y2064 WeakPolarHBondContact OD1-CD1 3.27Å; N2047-Y2064 WeakPolarHBondContact OD1-CE1 3.2Å; N2047-Y2064 PolarHBondContact OD1-N 3.31Å
2048	Q	85	Confident	76.6	Confident	94 Å²	94	65.4 Å²	65.4	44%	0.439	32%	0.324	S	S	.	.	S	Bend	trans	-145.2	-176.3	-180	65.4	-170.5	-2.3	0	0	111.4	N2045 F2046 R2057	N2045-Q2048 HydrophobicContact CB-CG 3.79Å; N2045-Q2048 PolarHBondContact OD1-NE2 3.23Å; N2045-Q2048 VanDerWaalsContact OD1-NE2 3.09Å; F2046-Q2048 PolarHBondContact O-N 3.09Å; Q2048-R2057 PolarHBondContact O-N 2.99Å
2049	Y	84	Confident	78.3	Confident	89 Å²	89	64.5 Å²	64.5	35%	0.349	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	125	175.1	-179.8	-105	0	0	0	110	A2051 R2056	Y2049-A2051 HydrophobicContact CE1-CB 4.44Å; Y2049-A2051 PolarHBondContact O-N 2.87Å; Y2049-R2056 HydrophobicContact CD2-CB 4.23Å
2050	D	82.7	Confident	79.7	Confident	7 Å²	7	60 Å²	60	4%	0.037	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	96.7	176.7	-173.3	-13.1	0	0	0	109.5	K2052 A2053 K2054 L2055 R2057	D2050-K2052 PolarHBondContact O-N 2.8Å; D2050-K2052 PolarHBondContact OD1-N 3.01Å; D2050-A2053 HydrophobicContact CB-CB 4.3Å; D2050-A2053 PolarHBondContact OD1-N 3.2Å; D2050-A2053 WeakPolarHBondContact OD2-CB 3.34Å; D2050-K2054 PolarHBondContact O-N 2.87Å; D2050-K2054 VanDerWaalsContact O-N 3.14Å; D2050-L2055 WeakPolarHBondContact CB-O 3.5Å; D2050-L2055 PolarHBondContact N-O 3.41Å; D2050-L2055 PolarHBondContact O-N 2.84Å; D2050-R2057 HydrophobicContact CB-CG 4.19Å; D2050-R2057 IonicContact OD2-CZ 3.16Å; D2050-R2057 IonicContact OD2-NE 3.49Å; D2050-R2057 PolarHBondContact OD2-NE 3Å; D2050-R2057 IonicContact OD2-NH2 3.22Å
2051	A	78.9	Confident	80.7	Confident	79 Å²	79	59.6 Å²	59.6	65%	0.653	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.8	179.4	0	0	0	0	0	113.3	Y2049	Y2049-A2051 HydrophobicContact CE1-CB 4.44Å; Y2049-A2051 PolarHBondContact O-N 2.87Å
2052	K	77.2	Confident	81.4	Confident	170 Å²	170	60.9 Å²	60.9	74%	0.739	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-52	-179.2	-172.1	-175.2	178.9	-173.4	0	111.4	D2050 K2054	D2050-K2052 PolarHBondContact O-N 2.8Å; D2050-K2052 PolarHBondContact OD1-N 3.01Å; K2052-K2054 WeakPolarHBondContact O-CG 3.23Å; K2052-K2054 PolarHBondContact O-N 2.81Å
2053	A	72.7	Confident	82.2	Confident	25 Å²	25	63.9 Å²	63.9	21%	0.207	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	5.8	-178.5	0	0	0	0	0	114.2	D2050 L2055	D2050-A2053 HydrophobicContact CB-CB 4.3Å; D2050-A2053 PolarHBondContact OD1-N 3.2Å; D2050-A2053 WeakPolarHBondContact OD2-CB 3.34Å; A2053-L2055 PolarHBondContact O-N 3.45Å
2054	K	77.7	Confident	82.9	Confident	99 Å²	99	60.4 Å²	60.4	43%	0.43	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	31.2	169	-39	173.2	-165.3	-178.7	0	112.2	E2019 D2050 K2052	E2019-K2054 IonicContact OE1-NZ 2.72Å; E2019-K2054 PolarHBondContact OE1-NZ 3.42Å; E2019-K2054 IonicContact OE2-NZ 2.72Å; E2019-K2054 PolarHBondContact OE2-NZ 2.89Å; D2050-K2054 PolarHBondContact O-N 2.87Å; D2050-K2054 VanDerWaalsContact O-N 3.14Å; K2052-K2054 WeakPolarHBondContact O-CG 3.23Å; K2052-K2054 PolarHBondContact O-N 2.81Å
2055	L	79.7	Confident	83.4	Confident	7 Å²	7	66.8 Å²	66.8	4%	0.037	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	138.8	-157.1	-176.2	70.1	0	0	0	114.3	D2050 A2053 R2057 R2090 D2141	D2050-L2055 WeakPolarHBondContact CB-O 3.5Å; D2050-L2055 PolarHBondContact N-O 3.41Å; D2050-L2055 PolarHBondContact O-N 2.84Å; A2053-L2055 PolarHBondContact O-N 3.45Å; L2055-R2057 HydrophobicContact CD2-CG 4.03Å; L2055-R2057 HydrophobicContact CG-CG 4.31Å; L2055-R2057 PolarHBondContact O-N 2.72Å; L2055-R2090 HydrophobicContact CD2-CB 4.42Å; L2055-R2090 HydrophobicContact CD2-CG 3.91Å; L2055-D2141 HydrophobicContact CD1-CB 3.8Å
2056	R	84.2	Confident	83.6	Confident	53 Å²	53	67.1 Å²	67.1	20%	0.2	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	109.6	168	-171.7	175.9	-174.7	173	1.5	111	Y2049 Q2058 H2142 C2146	Y2049-R2056 HydrophobicContact CD2-CB 4.23Å; R2056-Q2058 HydrophobicContact CG-CB 4.26Å; R2056-H2142 WeakPolarHBondContact CB-O 3.24Å; R2056-H2142 PolarHBondContact N-O 3.32Å; R2056-H2142 VanDerWaalsContact N-O 3.14Å; R2056-C2146 PolarHBondContact NH1-O 3.03Å
2057	R	85.8	Confident	83.4	Confident	3 Å²	3	68.2 Å²	68.2	1%	0.011	33%	0.329	C	S	.	.			trans	-97.2	23.3	-179.8	-62.1	-177.5	178	-85.1	-1.3	114.1	D2022 I2044 Q2048 D2050 L2055 Y2064 W2091	D2022-R2057 IonicContact OD1-NH2 2.95Å; D2022-R2057 PolarHBondContact OD1-NH2 2.7Å; D2022-R2057 IonicContact OD2-CZ 3.02Å; D2022-R2057 VanDerWaalsContact OD2-CZ 3.23Å; D2022-R2057 IonicContact OD2-NH1 3.2Å; D2022-R2057 PolarHBondContact OD2-NH1 2.84Å; D2022-R2057 IonicContact OD2-NH2 2.76Å; D2022-R2057 PolarHBondContact OD2-NH2 3.33Å; I2044-R2057 VanDerWaalsContact CG2-NE 3.27Å; Q2048-R2057 PolarHBondContact O-N 2.99Å; D2050-R2057 HydrophobicContact CB-CG 4.19Å; D2050-R2057 IonicContact OD2-CZ 3.16Å; D2050-R2057 IonicContact OD2-NE 3.49Å; D2050-R2057 PolarHBondContact OD2-NE 3Å; D2050-R2057 IonicContact OD2-NH2 3.22Å; L2055-R2057 HydrophobicContact CD2-CG 4.03Å; L2055-R2057 HydrophobicContact CG-CG 4.31Å; L2055-R2057 PolarHBondContact O-N 2.72Å; R2057-Y2064 WeakPolarHBondContact O-CE1 3.24Å; R2057-Y2064 PolarHBondContact O-OH 3.4Å; R2057-W2091 PolarHBondContact NH1-O 3.29Å
2058	Q	86.6	Confident	83	Confident	67 Å²	67	72 Å²	72	31%	0.313	36%	0.358	S	S	.	.			trans	-87.3	139.1	175.5	-72.6	174.7	-15.6	0	0	110	N2047 R2056 H2095	N2047-Q2058 WeakPolarHBondContact O-CG 3.03Å; R2056-Q2058 HydrophobicContact CG-CB 4.26Å; Q2058-H2095 PolarHBondContact O-CE1 3.31Å; Q2058-H2095 VanDerWaalsContact O-CE1 3.27Å; Q2058-H2095 PolarHBondContact O-NE2 3.3Å
2059	S	86.6	Confident	82.5	Confident	12 Å²	12	72.1 Å²	72.1	8%	0.084	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-83.8	149	174.6	162.2	0	0	0	0	111.1	L2061 G2062 E2205	S2059-L2061 PolarHBondContact O-N 2.64Å; S2059-L2061 PolarHBondContact OG-N 2.91Å; S2059-G2062 WeakPolarHBondContact CB-O 3.31Å; S2059-G2062 PolarHBondContact O-N 2.84Å; S2059-E2205 WeakPolarHBondContact CA-OE2 3.42Å; S2059-E2205 WeakPolarHBondContact CB-OE1 3.42Å; S2059-E2205 PolarHBondContact OG-OE1 2.81Å; S2059-E2205 PolarHBondContact OG-OE2 3.36Å
2060	L	83.9	Confident	82.1	Confident	44 Å²	44	69.4 Å²	69.4	23%	0.23	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-20.6	170.6	-61.9	-180	0	0	0	112.9	G2062 F2148 K2190 E2205	L2060-G2062 VanDerWaalsContact C-N 3.32Å; L2060-F2148 HydrophobicContact CD2-CB 4.44Å; L2060-F2148 HydrophobicContact CD2-CD1 3.9Å; L2060-F2148 HydrophobicContact CD2-CD2 3.64Å; L2060-F2148 HydrophobicContact CD2-CE1 3.95Å; L2060-F2148 HydrophobicContact CD2-CE2 3.67Å; L2060-F2148 HydrophobicContact CD2-CG 3.74Å; L2060-F2148 HydrophobicContact CD2-CZ 3.83Å; L2060-K2190 HydrophobicContact CD1-CG 4.02Å; L2060-E2205 WeakPolarHBondContact CB-OE2 3.35Å; L2060-E2205 HydrophobicContact CD1-CB 4.29Å; L2060-E2205 WeakPolarHBondContact CG-OE2 3.23Å; L2060-E2205 PolarHBondContact N-OE2 3.17Å
2061	L	83.2	Confident	82	Confident	92 Å²	92	69.7 Å²	69.7	48%	0.482	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-10.2	172.1	-60.9	-173.1	0	0	0	113.1	S2059 P2076 M2077	S2059-L2061 PolarHBondContact O-N 2.64Å; S2059-L2061 PolarHBondContact OG-N 2.91Å; L2061-P2076 HydrophobicContact CD1-CB 4.37Å; L2061-P2076 HydrophobicContact CD1-CG 4.14Å; L2061-M2077 HydrophobicContact CD1-CE 3.77Å
2062	G	82.8	Confident	82.1	Confident	36 Å²	36	66 Å²	66	37%	0.371	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	113.6	-146	-176.8	0	0	0	0	0	113	S2059 L2060	S2059-G2062 WeakPolarHBondContact CB-O 3.31Å; S2059-G2062 PolarHBondContact O-N 2.84Å; L2060-G2062 VanDerWaalsContact C-N 3.32Å
2063	R	86.9	Confident	82.7	Confident	227 Å²	227	58 Å²	58	86%	0.857	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-85.1	128.8	-178.8	-70.9	-174.8	178.1	-156.6	-0.4	111	N2047	N2047-R2063 HydrophobicContact CB-CG 4.5Å; N2047-R2063 WeakPolarHBondContact OD1-CA 3.07Å
2064	Y	89.2	Confident	83.6	Confident	13 Å²	13	58.1 Å²	58.1	5%	0.051	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-95.6	159.4	174.2	52	-95.9	0	0	0	111.9	F2046 N2047 R2057 L2066 P2073 P2093 W2203	F2046-Y2064 HydrophobicContact CB-CE2 3.95Å; F2046-Y2064 HydrophobicContact CD1-CE2 4.29Å; F2046-Y2064 HydrophobicContact CG-CE2 4.41Å; N2047-Y2064 PolarHBondContact N-OH 3.09Å; N2047-Y2064 PolarHBondContact ND2-O 3.07Å; N2047-Y2064 VanDerWaalsContact OD1-CD1 3.28Å; N2047-Y2064 WeakPolarHBondContact OD1-CD1 3.27Å; N2047-Y2064 WeakPolarHBondContact OD1-CE1 3.2Å; N2047-Y2064 PolarHBondContact OD1-N 3.31Å; R2057-Y2064 WeakPolarHBondContact O-CE1 3.24Å; R2057-Y2064 PolarHBondContact O-OH 3.4Å; Y2064-L2066 HydrophobicContact CD2-CD2 4.15Å; Y2064-L2066 HydrophobicContact CE2-CD2 3.85Å; Y2064-P2073 HydrophobicContact CD2-CB 3.72Å; Y2064-P2073 HydrophobicContact CE2-CB 3.48Å; Y2064-P2073 VanDerWaalsContact CE2-CB 3.48Å; Y2064-P2093 HydrophobicContact CE1-CG 4.06Å; Y2064-W2203 AromaticContact CD1-CH2 3.88Å; Y2064-W2203 HydrophobicContact CD1-CH2 3.88Å; Y2064-W2203 AromaticContact CD1-CZ2 3.73Å; Y2064-W2203 HydrophobicContact CD1-CZ2 3.73Å; Y2064-W2203 AromaticContact CD2-CH2 3.95Å; Y2064-W2203 HydrophobicContact CD2-CH2 3.95Å; Y2064-W2203 HydrophobicContact CE1-CH2 4.39Å; Y2064-W2203 HydrophobicContact CE1-CZ2 4.3Å; Y2064-W2203 HydrophobicContact CE2-CH2 4.49Å; Y2064-W2203 AromaticContact CG-CH2 3.63Å; Y2064-W2203 HydrophobicContact CG-CH2 3.63Å; Y2064-W2203 AromaticContact CG-CZ2 3.91Å; Y2064-W2203 HydrophobicContact CG-CZ2 3.91Å
2065	R	88.7	Confident	84.2	Confident	165 Å²	165	53.4 Å²	53.4	62%	0.623	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-81.1	153.4	178.3	-62.4	-177.9	-172.2	169	3.7	110.6	L2074	R2065-L2074 HydrophobicContact CB-CB 4.46Å; R2065-L2074 HydrophobicContact CB-CD1 4.17Å; R2065-L2074 PolarHBondContact O-N 3.15Å
2066	L	87	Confident	84.6	Confident	79 Å²	79	55.5 Å²	55.5	41%	0.414	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-110.5	141.8	172.2	-58.3	178.2	0	0	0	108.5	F2046 Y2064 S2068 A2072 P2073	F2046-L2066 HydrophobicContact CB-CD1 4.24Å; F2046-L2066 HydrophobicContact CB-CD2 3.75Å; F2046-L2066 HydrophobicContact CD2-CD1 4.32Å; F2046-L2066 HydrophobicContact CD2-CD2 3.88Å; F2046-L2066 HydrophobicContact CG-CD2 3.84Å; Y2064-L2066 HydrophobicContact CD2-CD2 4.15Å; Y2064-L2066 HydrophobicContact CE2-CD2 3.85Å; L2066-S2068 PolarHBondContact O-N 2.78Å; L2066-A2072 CarbonylContact C-O 3.56Å; L2066-A2072 WeakPolarHBondContact CA-O 3.49Å; L2066-P2073 HydrophobicContact CD2-CB 4.11Å
2067	D	82	Confident	84.9	Confident	42 Å²	42	58 Å²	58	23%	0.225	30%	0.303	C	S	.	.			trans	-63.9	129.9	170.8	174.5	16.5	0	0	0	109.9	T2069 T2070 G2071 A2072 L2074	D2067-T2069 VanDerWaalsContact C-N 3.26Å; D2067-T2069 PolarHBondContact O-N 3.4Å; D2067-T2069 PolarHBondContact OD1-N 3.37Å; D2067-T2069 PolarHBondContact OD1-OG1 2.85Å; D2067-T2069 VanDerWaalsContact OD1-OG1 3.09Å; D2067-T2069 PolarHBondContact OD2-OG1 3.16Å; D2067-T2070 WeakPolarHBondContact CB-OG1 3.39Å; D2067-T2070 WeakPolarHBondContact OD2-CB 3.1Å; D2067-T2070 WeakPolarHBondContact OD2-CG2 3.49Å; D2067-T2070 PolarHBondContact OD2-N 2.97Å; D2067-T2070 PolarHBondContact OD2-OG1 2.8Å; D2067-G2071 VanDerWaalsContact O-CA 3.26Å; D2067-G2071 WeakPolarHBondContact O-CA 3.17Å; D2067-G2071 PolarHBondContact O-N 2.94Å; D2067-A2072 PolarHBondContact N-O 3.34Å; D2067-L2074 HydrophobicContact CB-CD2 4.06Å; D2067-L2074 HydrophobicContact CB-CG 4.29Å
2068	S	78.3	Confident	85	Confident	109 Å²	109	58 Å²	58	76%	0.762	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.3	-178.1	56.6	0	0	0	0	112.8	L2066	L2066-S2068 PolarHBondContact O-N 2.78Å
2069	T	74.9	Confident	85.1	Confident	96 Å²	96	56.1 Å²	56.1	59%	0.589	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-55.1	-177.6	63.2	0	0	0	0	111.6	R2042 D2067	R2042-T2069 PolarHBondContact NH2-O 2.88Å; R2042-T2069 VanDerWaalsContact NH2-O 3.16Å; D2067-T2069 VanDerWaalsContact C-N 3.26Å; D2067-T2069 PolarHBondContact O-N 3.4Å; D2067-T2069 PolarHBondContact OD1-N 3.37Å; D2067-T2069 PolarHBondContact OD1-OG1 2.85Å; D2067-T2069 VanDerWaalsContact OD1-OG1 3.09Å; D2067-T2069 PolarHBondContact OD2-OG1 3.16Å
2070	T	74.8	Confident	85.1	Confident	33 Å²	33	56.5 Å²	56.5	20%	0.202	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-21.9	-175	64.2	0	0	0	0	114.5	F2026 D2067 A2072	F2026-T2070 HydrophobicContact CD2-CG2 4.41Å; F2026-T2070 HydrophobicContact CE2-CG2 3.69Å; F2026-T2070 HydrophobicContact CZ-CG2 3.9Å; D2067-T2070 WeakPolarHBondContact CB-OG1 3.39Å; D2067-T2070 WeakPolarHBondContact OD2-CB 3.1Å; D2067-T2070 WeakPolarHBondContact OD2-CG2 3.49Å; D2067-T2070 PolarHBondContact OD2-N 2.97Å; D2067-T2070 PolarHBondContact OD2-OG1 2.8Å; T2070-A2072 PolarHBondContact O-N 3.22Å; T2070-A2072 VanDerWaalsContact OG1-CB 3.3Å; T2070-A2072 WeakPolarHBondContact OG1-CB 3.46Å; T2070-A2072 PolarHBondContact OG1-N 2.99Å
2071	G	80.8	Confident	85	Confident	13 Å²	13	54.4 Å²	54.4	13%	0.134	28%	0.284	C	S	.	.			trans	73.2	5.3	-169	0	0	0	0	0	114	F2046 D2067	F2046-G2071 WeakPolarHBondContact CE2-O 3.5Å; D2067-G2071 VanDerWaalsContact O-CA 3.26Å; D2067-G2071 WeakPolarHBondContact O-CA 3.17Å; D2067-G2071 PolarHBondContact O-N 2.94Å
2072	A	82.2	Confident	84.8	Confident	2 Å²	2	50.9 Å²	50.9	2%	0.017	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-71.8	148.6	177.4	0	0	0	0	0	111.2	L2041 L2066 D2067 T2070	L2041-A2072 HydrophobicContact CD2-CB 4.28Å; L2066-A2072 CarbonylContact C-O 3.56Å; L2066-A2072 WeakPolarHBondContact CA-O 3.49Å; D2067-A2072 PolarHBondContact N-O 3.34Å; T2070-A2072 PolarHBondContact O-N 3.22Å; T2070-A2072 VanDerWaalsContact OG1-CB 3.3Å; T2070-A2072 WeakPolarHBondContact OG1-CB 3.46Å; T2070-A2072 PolarHBondContact OG1-N 2.99Å
2073	P	89.8	Confident	84.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-66.4	143.9	173.1	29.8	-34.9	0	0	0	110.7	F2046 Y2064 L2066 W2091 S2201 W2203	F2046-P2073 HydrophobicContact CD1-CB 4.38Å; F2046-P2073 HydrophobicContact CD1-CG 4.27Å; F2046-P2073 HydrophobicContact CE1-CB 4.47Å; F2046-P2073 HydrophobicContact CE1-CG 3.89Å; F2046-P2073 HydrophobicContact CZ-CG 4.37Å; Y2064-P2073 HydrophobicContact CD2-CB 3.72Å; Y2064-P2073 HydrophobicContact CE2-CB 3.48Å; Y2064-P2073 VanDerWaalsContact CE2-CB 3.48Å; L2066-P2073 HydrophobicContact CD2-CB 4.11Å; P2073-W2091 HydrophobicContact CG-CB 4.25Å; P2073-S2201 WeakPolarHBondContact CG-O 3.46Å; P2073-S2201 WeakPolarHBondContact O-CA 3.17Å; P2073-S2201 VanDerWaalsContact O-CB 3.27Å; P2073-S2201 WeakPolarHBondContact O-CB 3.14Å; P2073-S2201 PolarHBondContact O-OG 2.9Å; P2073-S2201 VanDerWaalsContact O-OG 3.13Å; P2073-W2203 HydrophobicContact CB-CH2 4.16Å; P2073-W2203 HydrophobicContact CB-CZ3 4.15Å
2074	L	89.9	Confident	84	Confident	28 Å²	28	41.3 Å²	41.3	15%	0.147	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-101.6	131.2	175.3	-66.3	174.4	0	0	0	109.5	W1996 R2065 D2067	W1996-L2074 HydrophobicContact CD2-CD1 4.47Å; W1996-L2074 HydrophobicContact CD2-CD2 4.26Å; W1996-L2074 HydrophobicContact CE3-CD2 4.26Å; W1996-L2074 HydrophobicContact CH2-CD2 3.81Å; W1996-L2074 HydrophobicContact CZ2-CD2 3.79Å; W1996-L2074 HydrophobicContact CZ3-CD2 4.04Å; R2065-L2074 HydrophobicContact CB-CB 4.46Å; R2065-L2074 HydrophobicContact CB-CD1 4.17Å; R2065-L2074 PolarHBondContact O-N 3.15Å; D2067-L2074 HydrophobicContact CB-CD2 4.06Å; D2067-L2074 HydrophobicContact CB-CG 4.29Å
2075	N	90.7	Very high	83.5	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-55.9	123.7	176.6	-178.4	-21.3	0	0	0	110.3	W1996 M2077 G2078 T2080 Y2192 A2199 D2200 W2203	W1996-N2075 VanDerWaalsContact CD1-O 3.27Å; W1996-N2075 PolarHBondContact NE1-O 2.66Å; N2075-M2077 PolarHBondContact O-N 3.39Å; N2075-M2077 PolarHBondContact OD1-N 3.05Å; N2075-G2078 WeakPolarHBondContact CB-O 3.42Å; N2075-G2078 PolarHBondContact O-N 2.91Å; N2075-G2078 VanDerWaalsContact O-N 3.17Å; N2075-T2080 VanDerWaalsContact ND2-CG2 3.34Å; N2075-T2080 WeakPolarHBondContact ND2-CG2 3.45Å; N2075-Y2192 PolarHBondContact ND2-OH 3.05Å; N2075-Y2192 VanDerWaalsContact ND2-OH 3.08Å; N2075-Y2192 VanDerWaalsContact OD1-CE2 3.32Å; N2075-Y2192 WeakPolarHBondContact OD1-CE2 3.44Å; N2075-A2199 PolarHBondContact ND2-O 3.28Å; N2075-D2200 PolarHBondContact N-O 3.05Å; N2075-W2203 HydrophobicContact CB-CE3 3.96Å; N2075-W2203 HydrophobicContact CB-CZ3 4.41Å
2076	P	89.5	Confident	82.9	Confident	50 Å²	50	34 Å²	34	33%	0.325	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.5	-176.7	24.4	-34.4	0	0	0	113.9	L2061 Y2192 W2203	L2061-P2076 HydrophobicContact CD1-CB 4.37Å; L2061-P2076 HydrophobicContact CD1-CG 4.14Å; P2076-Y2192 HydrophobicContact CG-CD2 4.41Å; P2076-W2203 VanDerWaalsContact CD-CE2 3.42Å; P2076-W2203 VanDerWaalsContact CD-CZ2 3.49Å; P2076-W2203 HydrophobicContact CG-CD2 4.44Å; P2076-W2203 HydrophobicContact CG-CZ2 4.1Å
2077	M	88.5	Confident	82.4	Confident	106 Å²	106	31.6 Å²	31.6	52%	0.522	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-15.1	178.8	-66.5	-60.3	96.5	0	0	114	L2061 N2075 Y2192	L2061-M2077 HydrophobicContact CD1-CE 3.77Å; N2075-M2077 PolarHBondContact O-N 3.39Å; N2075-M2077 PolarHBondContact OD1-N 3.05Å; M2077-Y2192 HydrophobicContact CB-CE1 4.16Å; M2077-Y2192 HydrophobicContact CB-CE2 4.25Å; M2077-Y2192 HydrophobicContact CG-CD1 3.58Å; M2077-Y2192 HydrophobicContact CG-CD2 3.85Å; M2077-Y2192 HydrophobicContact CG-CE1 3.45Å; M2077-Y2192 VanDerWaalsContact CG-CE1 3.45Å; M2077-Y2192 HydrophobicContact CG-CE2 3.7Å; M2077-Y2192 HydrophobicContact CG-CG 3.78Å; M2077-Y2192 HydrophobicContact SD-CD1 4.44Å
2078	G	88.4	Confident	82.4	Confident	2 Å²	2	29.8 Å²	29.8	2%	0.021	18%	0.179	C	C	.	.			trans	129	-172.1	178.9	0	0	0	0	0	114.4	M1994 W1996 N2075	M1994-G2078 CarbonylContact O-C 3.37Å; M1994-G2078 WeakPolarHBondContact O-CA 3.45Å; W1996-G2078 VanDerWaalsContact NE1-C 3.34Å; W1996-G2078 PolarHBondContact NE1-O 3.44Å; N2075-G2078 WeakPolarHBondContact CB-O 3.42Å; N2075-G2078 PolarHBondContact O-N 2.91Å; N2075-G2078 VanDerWaalsContact O-N 3.17Å
2079	R	88.9	Confident	82.5	Confident	28 Å²	28	25 Å²	25	11%	0.106	15%	0.146	C	C	.	.			trans	-65.5	134.9	171.6	-69.2	176.5	-169.5	94.8	0.3	109.9	V1989 R1993 M1994 A1995 W1996 V1998 Y2003	V1989-R2079 HydrophobicContact CG1-CB 3.93Å; V1989-R2079 HydrophobicContact CG2-CB 4.26Å; R1993-R2079 PolarHBondContact O-NH1 3.22Å; M1994-R2079 PolarHBondContact O-N 2.92Å; A1995-R2079 PolarHBondContact O-NH1 3.32Å; W1996-R2079 HydrophobicContact CD2-CG 3.98Å; W1996-R2079 HydrophobicContact CE3-CG 3.62Å; W1996-R2079 HydrophobicContact CH2-CB 4.42Å; W1996-R2079 HydrophobicContact CH2-CG 3.55Å; W1996-R2079 HydrophobicContact CZ2-CB 4.49Å; W1996-R2079 HydrophobicContact CZ2-CG 3.9Å; W1996-R2079 HydrophobicContact CZ3-CG 3.4Å; W1996-R2079 VanDerWaalsContact CZ3-CG 3.4Å; V1998-R2079 PolarHBondContact O-NH1 3.13Å; V1998-R2079 PolarHBondContact O-NH2 3.43Å; Y2003-R2079 HydrophobicContact CD2-CG 4.49Å; Y2003-R2079 HydrophobicContact CE1-CB 4.48Å; Y2003-R2079 HydrophobicContact CE1-CG 4.06Å; Y2003-R2079 HydrophobicContact CE2-CB 3.84Å; Y2003-R2079 HydrophobicContact CE2-CG 4.09Å
2080	T	85.9	Confident	83.1	Confident	20 Å²	20	20.8 Å²	20.8	12%	0.123	12%	0.119	C	C	.	.			trans	-117.8	-9.9	-175.8	70	0	0	0	0	113.1	R1986 N2075 A2199 D2200	R1986-T2080 PolarHBondContact NH1-O 2.85Å; N2075-T2080 VanDerWaalsContact ND2-CG2 3.34Å; N2075-T2080 WeakPolarHBondContact ND2-CG2 3.45Å; T2080-A2199 VanDerWaalsContact OG1-CA 3.27Å; T2080-A2199 WeakPolarHBondContact OG1-CA 3.44Å; T2080-D2200 WeakPolarHBondContact CA-OD1 3.44Å; T2080-D2200 WeakPolarHBondContact CB-OD1 3.36Å; T2080-D2200 PolarHBondContact N-OD1 3.33Å; T2080-D2200 PolarHBondContact OG1-N 2.79Å; T2080-D2200 PolarHBondContact OG1-OD1 2.84Å
2081	G	82.4	Confident	83.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	82.4	6.6	-179.5	0	0	0	0	0	115.1	M1987 Y2003 Y2006 D2200	M1987-G2081 PolarHBondContact N-O 2.91Å; M1987-G2081 VanDerWaalsContact N-O 3.13Å; Y2003-G2081 WeakPolarHBondContact OH-CA 3.18Å; Y2003-G2081 PolarHBondContact OH-N 3.05Å; Y2006-G2081 PolarHBondContact N-O 2.65Å; Y2006-G2081 VanDerWaalsContact N-O 3.12Å; G2081-D2200 PolarHBondContact N-OD1 3.03Å
2082	L	80.2	Confident	84	Confident	19 Å²	19	19.1 Å²	19.1	10%	0.099	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120	179.2	-92.8	153.1	0	0	0	110.7	R1986 A2008 A2199 D2200	R1986-L2082 HydrophobicContact CG-CD1 3.59Å; R1986-L2082 HydrophobicContact CG-CG 4.03Å; R1986-L2082 VanDerWaalsContact CZ-CD1 3.42Å; A2008-L2082 HydrophobicContact CB-CD2 3.37Å; L2082-A2199 HydrophobicContact CB-CB 4.02Å; L2082-D2200 WeakPolarHBondContact O-CB 3.4Å; L2082-D2200 VanDerWaalsContact O-CG 3.29Å; L2082-D2200 PolarHBondContact O-N 2.94Å
2083	L	77	Confident	84.4	Confident	61 Å²	61	19.4 Å²	19.4	32%	0.319	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	148.6	-179.5	-159.7	79.6	0	0	0	110.5	A2005 Y2006 F2026	A2005-L2083 HydrophobicContact CB-CB 3.86Å; A2005-L2083 HydrophobicContact CB-CD1 4.05Å; Y2006-L2083 PolarHBondContact O-N 2.91Å; F2026-L2083 HydrophobicContact CB-CD2 4.4Å
2084	G	75.7	Confident	84.4	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.01	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	-144.7	175.8	0	0	0	0	0	112.9	A2199 S2201	G2084-A2199 WeakPolarHBondContact O-CB 3.4Å; G2084-S2201 WeakPolarHBondContact O-CB 3.36Å; G2084-S2201 PolarHBondContact O-N 3.32Å
2085	K	77.9	Confident	84.5	Confident	5 Å²	5	18.8 Å²	18.8	2%	0.022	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-18.3	178.8	-53.4	-174.1	-167.1	71.7	0	114.3	D2022 G2023 V2024 N2025 L2087 L2088 W2091 A2202	D2022-K2085 VanDerWaalsContact O-CE 3.3Å; D2022-K2085 WeakPolarHBondContact O-CE 3.33Å; D2022-K2085 PolarHBondContact O-NZ 2.9Å; G2023-K2085 VanDerWaalsContact C-NZ 3.3Å; G2023-K2085 PolarHBondContact O-NZ 3.2Å; V2024-K2085 PolarHBondContact O-NZ 3.07Å; N2025-K2085 PolarHBondContact OD1-N 3.39Å; K2085-L2087 PolarHBondContact O-N 3.45Å; K2085-L2088 WeakPolarHBondContact CB-O 3.5Å; K2085-L2088 VanDerWaalsContact CD-O 3.24Å; K2085-L2088 WeakPolarHBondContact CD-O 3.3Å; K2085-L2088 PolarHBondContact O-N 3.46Å; K2085-W2091 HydrophobicContact CD-CD2 4.37Å; K2085-W2091 VanDerWaalsContact CE-CE2 3.49Å; K2085-W2091 HydrophobicContact CG-CD2 3.87Å; K2085-W2091 HydrophobicContact CG-CE3 3.76Å; K2085-W2091 HydrophobicContact CG-CH2 4.26Å; K2085-W2091 HydrophobicContact CG-CZ2 4.34Å; K2085-W2091 HydrophobicContact CG-CZ3 3.98Å; K2085-W2091 VanDerWaalsContact NZ-CE2 3.34Å; K2085-A2202 HydrophobicContact CB-CB 4Å; K2085-A2202 HydrophobicContact CG-CB 4.44Å
2086	G	76.3	Confident	84.4	Confident	19 Å²	19	19 Å²	19	20%	0.196	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	-129.5	-156.9	0	0	0	0	0	111.3
2087	L	76.7	Confident	84.5	Confident	29 Å²	29	16.6 Å²	16.6	15%	0.152	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	0.6	-176.5	-61.3	168.3	0	0	0	113.7	M1974 E1980 E2011 L2013 K2085 L2197	M1974-L2087 HydrophobicContact CE-CB 4.41Å; E1980-L2087 HydrophobicContact CG-CD1 4.5Å; E2011-L2087 HydrophobicContact CB-CD2 3.9Å; L2013-L2087 HydrophobicContact CD1-CB 3.84Å; L2013-L2087 HydrophobicContact CD1-CD2 3.71Å; L2013-L2087 HydrophobicContact CD1-CG 4.26Å; K2085-L2087 PolarHBondContact O-N 3.45Å; L2087-L2197 HydrophobicContact CB-CD2 4.09Å; L2087-L2197 HydrophobicContact CD1-CD2 3.98Å
2088	L	82.1	Confident	84.6	Confident	3 Å²	3	11.6 Å²	11.6	2%	0.016	7%	0.065	C	C	.	.			trans	-79.8	142.1	-178.7	-68.1	173.1	0	0	0	112	K2085 N2094 L2197 A2202 M2204	K2085-L2088 WeakPolarHBondContact CB-O 3.5Å; K2085-L2088 VanDerWaalsContact CD-O 3.24Å; K2085-L2088 WeakPolarHBondContact CD-O 3.3Å; K2085-L2088 PolarHBondContact O-N 3.46Å; L2088-N2094 HydrophobicContact CD2-CB 4.38Å; L2088-L2197 HydrophobicContact CD2-CB 4.2Å; L2088-L2197 HydrophobicContact CD2-CD1 4.45Å; L2088-L2197 HydrophobicContact CG-CB 4.37Å; L2088-A2202 HydrophobicContact CB-CB 4.06Å; L2088-A2202 HydrophobicContact CD1-CB 3.83Å; L2088-M2204 HydrophobicContact CD1-CG 4.16Å; L2088-M2204 HydrophobicContact CD2-CG 3.66Å; L2088-M2204 HydrophobicContact CD2-SD 4.03Å
2089	P	80.7	Confident	84.7	Confident	9 Å²	9	11.8 Å²	11.8	6%	0.058	7%	0.065	C	C	.	.	S	Bend	trans	-70.6	-32.8	-174.9	23.2	-30.9	0	0	0	114.4	F2015 H2021 D2022 N2094 L2139	F2015-P2089 HydrophobicContact CE1-CB 3.88Å; F2015-P2089 HydrophobicContact CZ-CB 4.44Å; H2021-P2089 WeakPolarHBondContact CA-O 3.33Å; D2022-P2089 PolarHBondContact N-O 2.92Å; P2089-N2094 WeakPolarHBondContact CD-OD1 3.33Å; P2089-L2139 HydrophobicContact CG-CD1 4.19Å
2090	R	85.8	Confident	84.8	Confident	7 Å²	7	10.5 Å²	10.5	3%	0.026	6%	0.06	C	C	.	.	S	Bend	trans	-116.4	148	-172.1	-54.6	-63.4	-177.1	-162.1	-6.5	112.6	E2019 S2020 D2022 L2055 N2094 D2141 A2202	E2019-R2090 PolarHBondContact O-NH1 2.79Å; E2019-R2090 VanDerWaalsContact O-NH1 3.14Å; E2019-R2090 PolarHBondContact O-NH2 2.88Å; S2020-R2090 VanDerWaalsContact O-CZ 3.28Å; S2020-R2090 PolarHBondContact O-NH2 3.28Å; D2022-R2090 WeakPolarHBondContact OD1-CD 3.45Å; D2022-R2090 IonicContact OD1-CZ 2.95Å; D2022-R2090 IonicContact OD1-NE 2.72Å; D2022-R2090 IonicContact OD1-NH1 3.24Å; D2022-R2090 PolarHBondContact OD1-NH1 3.12Å; D2022-R2090 WeakPolarHBondContact OD2-CA 3.45Å; D2022-R2090 WeakPolarHBondContact OD2-CD 3.33Å; L2055-R2090 HydrophobicContact CD2-CB 4.42Å; L2055-R2090 HydrophobicContact CD2-CG 3.91Å; R2090-N2094 WeakPolarHBondContact CB-OD1 3.4Å; R2090-N2094 PolarHBondContact N-OD1 3.5Å; R2090-N2094 VanDerWaalsContact N-OD1 3.13Å; R2090-N2094 PolarHBondContact O-ND2 3.43Å; R2090-D2141 IonicContact NH2-OD2 3.54Å; R2090-A2202 WeakPolarHBondContact O-CB 3.26Å
2091	W	86.6	Confident	85	Confident	11 Å²	11	9.7 Å²	9.7	4%	0.042	6%	0.055	C	C	.	.	S	Bend	trans	-70.5	134.6	167.7	-65.2	109.9	0	0	0	111.5	D2022 V2024 L2041 F2046 R2057 P2073 K2085	D2022-W2091 HydrophobicContact CB-CG 4.28Å; D2022-W2091 PolarHBondContact O-NE1 3.21Å; D2022-W2091 PolarHBondContact OD2-N 2.83Å; V2024-W2091 WeakPolarHBondContact O-CZ2 3.29Å; L2041-W2091 HydrophobicContact CD1-CH2 4.37Å; L2041-W2091 HydrophobicContact CD1-CZ2 4.18Å; L2041-W2091 HydrophobicContact CD2-CD2 3.87Å; L2041-W2091 HydrophobicContact CD2-CE3 4.23Å; L2041-W2091 HydrophobicContact CD2-CG 4.29Å; L2041-W2091 HydrophobicContact CD2-CH2 4.32Å; L2041-W2091 HydrophobicContact CD2-CZ2 3.98Å; L2041-W2091 HydrophobicContact CD2-CZ3 4.43Å; L2041-W2091 HydrophobicContact CG-CZ2 4.34Å; F2046-W2091 HydrophobicContact CE1-CB 3.75Å; F2046-W2091 HydrophobicContact CZ-CB 4.13Å; R2057-W2091 PolarHBondContact NH1-O 3.29Å; P2073-W2091 HydrophobicContact CG-CB 4.25Å; K2085-W2091 HydrophobicContact CD-CD2 4.37Å; K2085-W2091 VanDerWaalsContact CE-CE2 3.49Å; K2085-W2091 HydrophobicContact CG-CD2 3.87Å; K2085-W2091 HydrophobicContact CG-CE3 3.76Å; K2085-W2091 HydrophobicContact CG-CH2 4.26Å; K2085-W2091 HydrophobicContact CG-CZ2 4.34Å; K2085-W2091 HydrophobicContact CG-CZ3 3.98Å; K2085-W2091 VanDerWaalsContact NZ-CE2 3.34Å
2092	G	88.7	Confident	85.5	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.3	-139.7	-179.7	0	0	0	0	0	112.7	N2094 S2201 A2202 W2203	G2092-N2094 PolarHBondContact O-N 2.94Å; G2092-N2094 PolarHBondContact O-ND2 3.44Å; G2092-N2094 VanDerWaalsContact O-ND2 3.1Å; G2092-S2201 PolarHBondContact N-O 2.8Å; G2092-A2202 WeakPolarHBondContact O-CA 3.47Å; G2092-W2203 PolarHBondContact O-N 2.91Å
2093	P	90.5	Very high	85.9	Confident	8 Å²	8	10.9 Å²	10.9	5%	0.052	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	126.7	-175.9	29.3	-33.9	0	0	0	112	Y2064 W2203 E2205	Y2064-P2093 HydrophobicContact CE1-CG 4.06Å; P2093-W2203 HydrophobicContact CB-CZ2 4.23Å; P2093-W2203 HydrophobicContact CG-CZ2 4.43Å; P2093-E2205 HydrophobicContact CB-CG 4.35Å
2094	N	90.5	Very high	86.4	Confident	7 Å²	7	9.8 Å²	9.8	4%	0.037	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	104.9	172.1	-70.6	-100.2	0	0	0	108.4	L2088 P2089 R2090 G2092 L2139 W2203 M2204 E2205	L2088-N2094 HydrophobicContact CD2-CB 4.38Å; P2089-N2094 WeakPolarHBondContact CD-OD1 3.33Å; R2090-N2094 WeakPolarHBondContact CB-OD1 3.4Å; R2090-N2094 PolarHBondContact N-OD1 3.5Å; R2090-N2094 VanDerWaalsContact N-OD1 3.13Å; R2090-N2094 PolarHBondContact O-ND2 3.43Å; G2092-N2094 PolarHBondContact O-N 2.94Å; G2092-N2094 PolarHBondContact O-ND2 3.44Å; G2092-N2094 VanDerWaalsContact O-ND2 3.1Å; N2094-L2139 HydrophobicContact CB-CD2 4.09Å; N2094-W2203 WeakPolarHBondContact CB-O 3.5Å; N2094-W2203 PolarHBondContact N-O 3.4Å; N2094-W2203 PolarHBondContact ND2-O 3.3Å; N2094-M2204 WeakPolarHBondContact O-CA 3.25Å; N2094-E2205 PolarHBondContact O-N 3.38Å
2095	H	90.6	Very high	86.9	Confident	9 Å²	9	9.9 Å²	9.9	4%	0.042	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	140.6	-178	-57.9	101.9	0	0	0	111.2	Q2058 L2139 T2140 H2142 F2148 E2205	Q2058-H2095 PolarHBondContact O-CE1 3.31Å; Q2058-H2095 VanDerWaalsContact O-CE1 3.27Å; Q2058-H2095 PolarHBondContact O-NE2 3.3Å; H2095-L2139 CarbonylContact O-C 3.6Å; H2095-L2139 WeakPolarHBondContact O-CA 3.49Å; H2095-T2140 PolarHBondContact O-N 3.23Å; H2095-H2142 AromaticContact CG-CD2 3.9Å; H2095-F2148 AromaticContact CD2-CE1 3.61Å; H2095-F2148 AromaticContact CE1-CE1 3.85Å; H2095-F2148 AromaticContact NE2-CE1 3.43Å; H2095-F2148 WeakPolarHBondContact NE2-CE1 3.33Å; H2095-F2148 AromaticContact NE2-CZ 3.8Å; H2095-E2205 CarbonylContact C-O 3.58Å; H2095-E2205 WeakPolarHBondContact CA-O 3.46Å; H2095-E2205 IonicContact NE2-OE2 2.77Å
2096	S	89.9	Confident	87	Confident	4 Å²	4	14.5 Å²	14.5	3%	0.028	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	169.1	-179.9	63.3	0	0	0	0	112	Y2138 E2205 T2206 V2207	S2096-Y2138 CarbonylContact C-O 3.49Å; S2096-Y2138 WeakPolarHBondContact CA-O 3.47Å; S2096-Y2138 WeakPolarHBondContact CB-O 3.11Å; S2096-E2205 PolarHBondContact N-O 2.9Å; S2096-E2205 PolarHBondContact OG-O 3.42Å; S2096-E2205 VanDerWaalsContact OG-O 3.05Å; S2096-T2206 CarbonylContact O-C 3.5Å; S2096-T2206 VanDerWaalsContact O-CA 3.28Å; S2096-T2206 WeakPolarHBondContact O-CA 3.48Å; S2096-T2206 PolarHBondContact O-OG1 3.17Å; S2096-T2206 WeakPolarHBondContact OG-CA 3.48Å; S2096-T2206 WeakPolarHBondContact OG-CB 3.24Å; S2096-T2206 PolarHBondContact OG-OG1 2.82Å; S2096-V2207 PolarHBondContact O-N 2.94Å
2097	F	90.6	Very high	87	Confident	1 Å²	1	15.5 Å²	15.5	0%	0.004	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	149.3	163.5	68.1	-95.9	0	0	0	111.8	L1971 W2137 Y2138 T2140 V2152 I2155 I2156 L2159 V2207	L1971-F2097 HydrophobicContact CD1-CD1 4.36Å; L1971-F2097 HydrophobicContact CD1-CE1 3.29Å; L1971-F2097 HydrophobicContact CD1-CZ 3.71Å; F2097-W2137 VanDerWaalsContact O-CA 3.28Å; F2097-W2137 WeakPolarHBondContact O-CA 3.29Å; F2097-Y2138 HydrophobicContact CD2-CD2 4.26Å; F2097-Y2138 HydrophobicContact CE1-CD2 4.41Å; F2097-Y2138 HydrophobicContact CE1-CG 4.42Å; F2097-Y2138 AromaticContact CE2-CD2 3.41Å; F2097-Y2138 HydrophobicContact CE2-CD2 3.41Å; F2097-Y2138 VanDerWaalsContact CE2-CD2 3.41Å; F2097-Y2138 HydrophobicContact CE2-CE2 4.11Å; F2097-Y2138 HydrophobicContact CE2-CG 4.19Å; F2097-Y2138 AromaticContact CZ-CD2 3.5Å; F2097-Y2138 HydrophobicContact CZ-CD2 3.5Å; F2097-Y2138 HydrophobicContact CZ-CE2 4.33Å; F2097-Y2138 AromaticContact CZ-CG 3.85Å; F2097-Y2138 HydrophobicContact CZ-CG 3.85Å; F2097-Y2138 PolarHBondContact N-O 3.34Å; F2097-Y2138 PolarHBondContact O-N 3.02Å; F2097-T2140 HydrophobicContact CD1-CG2 3.64Å; F2097-T2140 HydrophobicContact CE1-CG2 3.64Å; F2097-V2152 HydrophobicContact CB-CG1 3.73Å; F2097-V2152 HydrophobicContact CD1-CG1 4.23Å; F2097-V2152 HydrophobicContact CG-CG1 4.01Å; F2097-I2155 HydrophobicContact CE1-CG2 3.82Å; F2097-I2155 HydrophobicContact CZ-CG2 4.24Å; F2097-I2156 HydrophobicContact CD2-CD1 3.93Å; F2097-I2156 HydrophobicContact CD2-CG1 3.96Å; F2097-I2156 HydrophobicContact CE2-CD1 4.14Å; F2097-I2156 HydrophobicContact CE2-CG1 3.67Å; F2097-I2156 HydrophobicContact CG-CD1 4.49Å; F2097-I2156 HydrophobicContact CZ-CG1 4.03Å; F2097-L2159 HydrophobicContact CZ-CD2 4.37Å; F2097-V2207 CarbonylContact C-O 3.3Å; F2097-V2207 WeakPolarHBondContact CA-O 3.46Å; F2097-V2207 VanDerWaalsContact CB-O 3.29Å; F2097-V2207 WeakPolarHBondContact CB-O 3.25Å
2098	V	90.9	Very high	86.8	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.006	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129	176.8	-179.4	0	0	0	0	109.3	M2135 W2137 V2207 V2208 I2209	V2098-M2135 HydrophobicContact CG1-CB 3.9Å; V2098-W2137 HydrophobicContact CG2-CB 3.91Å; V2098-V2207 PolarHBondContact N-O 2.71Å; V2098-V2208 HydrophobicContact CB-CG1 4.26Å; V2098-V2208 HydrophobicContact CB-CG2 4.25Å; V2098-V2208 HydrophobicContact CG1-CG1 4.49Å; V2098-I2209 PolarHBondContact O-N 3.31Å
2099	L	90.2	Very high	86.3	Confident	5 Å²	5	29.8 Å²	29.8	3%	0.026	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	105.2	-179.1	-172.9	68	0	0	0	110.8	I2101 P2136 I2156 L2211 L2229	L2099-I2101 HydrophobicContact CD2-CD1 3.88Å; L2099-I2101 HydrophobicContact CD2-CG1 4.22Å; L2099-I2101 HydrophobicContact CG-CD1 4.23Å; L2099-I2101 HydrophobicContact CG-CG1 4.01Å; L2099-P2136 PolarHBondContact N-O 2.84Å; L2099-I2156 HydrophobicContact CD1-CD1 4.45Å; L2099-I2156 HydrophobicContact CD1-CG2 4.26Å; L2099-L2211 HydrophobicContact CD1-CD1 3.76Å; L2099-L2211 HydrophobicContact CD1-CG 4.03Å; L2099-L2229 HydrophobicContact CD2-CD2 4.31Å
2100	C	91.4	Very high	85.9	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	112.6	175.1	-169.9	0	0	0	0	109.6	M2135 I2188 I2209 N2210 L2211	C2100-M2135 HydrophobicContact CB-SD 3.98Å; C2100-I2188 HydrophobicContact CB-CD1 4.33Å; C2100-I2209 PolarHBondContact N-O 3.48Å; C2100-N2210 CarbonylContact O-C 3.39Å; C2100-N2210 WeakPolarHBondContact O-CA 3.35Å; C2100-N2210 PolarHBondContact O-OD1 3.49Å; C2100-L2211 PolarHBondContact O-N 3.37Å
2101	I	90.9	Very high	85	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.015	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.3	177.9	-58.2	167.5	0	0	0	108.2	L2099 Y2124 L2125 L2211 L2221 I2225 L2229 W2240	L2099-I2101 HydrophobicContact CD2-CD1 3.88Å; L2099-I2101 HydrophobicContact CD2-CG1 4.22Å; L2099-I2101 HydrophobicContact CG-CD1 4.23Å; L2099-I2101 HydrophobicContact CG-CG1 4.01Å; I2101-Y2124 CarbonylContact O-C 3.53Å; I2101-Y2124 WeakPolarHBondContact O-CA 3.37Å; I2101-L2125 HydrophobicContact CB-CB 4.04Å; I2101-L2125 HydrophobicContact CD1-CD1 4.07Å; I2101-L2125 PolarHBondContact O-N 3.38Å; I2101-L2211 WeakPolarHBondContact CA-O 3.3Å; I2101-L2211 HydrophobicContact CG1-CB 4.37Å; I2101-L2211 HydrophobicContact CG1-CD1 4.38Å; I2101-L2221 HydrophobicContact CG2-CD1 3.73Å; I2101-I2225 HydrophobicContact CD1-CD1 3.84Å; I2101-I2225 HydrophobicContact CD1-CG1 4.25Å; I2101-I2225 HydrophobicContact CG2-CD1 4.21Å; I2101-L2229 HydrophobicContact CD1-CD1 3.75Å; I2101-W2240 HydrophobicContact CG2-CH2 3.78Å; I2101-W2240 HydrophobicContact CG2-CZ3 4.22Å
2102	T	91.2	Very high	84.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	144.1	-174	59.3	0	0	0	0	113.5	L2122 Q2123 N2210 L2211 H2212 E2213 V2260	T2102-L2122 HydrophobicContact CG2-CD2 4.15Å; T2102-Q2123 CarbonylContact C-O 3.49Å; T2102-Q2123 VanDerWaalsContact CA-O 3.28Å; T2102-Q2123 WeakPolarHBondContact CA-O 3.37Å; T2102-N2210 PolarHBondContact OG1-OD1 2.92Å; T2102-L2211 PolarHBondContact N-O 2.84Å; T2102-H2212 WeakPolarHBondContact O-CA 3.44Å; T2102-H2212 PolarHBondContact O-ND1 3.4Å; T2102-H2212 PolarHBondContact OG1-ND1 3.4Å; T2102-E2213 PolarHBondContact O-N 3.06Å; T2102-V2260 HydrophobicContact CG2-CG1 4.04Å
2103	R	88.9	Confident	84	Confident	44 Å²	44	41 Å²	41	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	160.6	174.6	72.4	178.4	-172	-169.6	-2.3	111.8	Q2123 E2213 D2223 W2240	R2103-Q2123 HydrophobicContact CG-CB 4.11Å; R2103-Q2123 PolarHBondContact N-O 2.71Å; R2103-Q2123 VanDerWaalsContact NH2-OE1 3.15Å; R2103-Q2123 PolarHBondContact O-N 3.46Å; R2103-E2213 HydrophobicContact CB-CB 3.86Å; R2103-D2223 IonicContact CZ-OD1 2.8Å; R2103-D2223 IonicContact NH1-OD1 3.77Å; R2103-D2223 PolarHBondContact NH1-OD1 3.33Å; R2103-D2223 IonicContact NH2-OD1 3.01Å; R2103-W2240 HydrophobicContact CB-CZ3 4.46Å; R2103-W2240 HydrophobicContact CG-CE3 4.1Å; R2103-W2240 HydrophobicContact CG-CH2 4.16Å; R2103-W2240 HydrophobicContact CG-CZ3 3.84Å; R2103-W2240 VanDerWaalsContact CZ-CE2 3.48Å
2104	W	88.8	Confident	83.6	Confident	38 Å²	38	43.3 Å²	43.3	14%	0.144	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	139.6	175.9	-67.6	109.2	0	0	0	112.5	R2106 Q2113 L2122 H2212	W2104-R2106 PolarHBondContact O-N 3.34Å; W2104-Q2113 HydrophobicContact CB-CG 4.34Å; W2104-Q2113 VanDerWaalsContact CD2-NE2 3.27Å; W2104-Q2113 HydrophobicContact CE3-CG 4.47Å; W2104-L2122 HydrophobicContact CD2-CD1 4.4Å; W2104-L2122 HydrophobicContact CE3-CD1 4.09Å; W2104-L2122 HydrophobicContact CZ3-CD1 4.25Å; W2104-H2212 AromaticContact CE2-NE2 3.88Å; W2104-H2212 AromaticContact NE1-CE1 3.74Å; W2104-H2212 AromaticContact NE1-NE2 3.33Å; W2104-H2212 PolarHBondContact NE1-NE2 3Å
2105	T	85.7	Confident	83.1	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.025	25%	0.249	C	C	.	.			trans	-71.1	123.7	173	-47.9	0	0	0	0	109.7	Q2113 I2114 V2121 Q2123	T2105-Q2113 CarbonylContact O-C 3.5Å; T2105-Q2113 VanDerWaalsContact O-CA 3.3Å; T2105-Q2113 WeakPolarHBondContact O-CA 3.42Å; T2105-I2114 HydrophobicContact CG2-CB 4.39Å; T2105-I2114 HydrophobicContact CG2-CD1 3.67Å; T2105-I2114 HydrophobicContact CG2-CG1 4.12Å; T2105-I2114 PolarHBondContact O-N 2.98Å; T2105-V2121 VanDerWaalsContact CB-O 3.31Å; T2105-V2121 WeakPolarHBondContact CB-O 3.43Å; T2105-V2121 PolarHBondContact N-O 3.48Å; T2105-V2121 PolarHBondContact OG1-O 2.92Å; T2105-Q2123 HydrophobicContact CG2-CG 4.42Å; T2105-Q2123 VanDerWaalsContact OG1-CG 3.25Å; T2105-Q2123 WeakPolarHBondContact OG1-CG 3.34Å
2106	R	80.8	Confident	82.5	Confident	102 Å²	102	52.8 Å²	52.8	39%	0.385	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-117.2	139.5	-179.1	-62.4	173.7	-176.3	-89.9	0.1	111.2	W2104 T2108 A2112 E2213	W2104-R2106 PolarHBondContact O-N 3.34Å; R2106-T2108 PolarHBondContact O-N 3.44Å; R2106-A2112 CarbonylContact C-O 3.56Å; R2106-A2112 VanDerWaalsContact CA-O 3.24Å; R2106-A2112 WeakPolarHBondContact CA-O 3.44Å; R2106-E2213 IonicContact CZ-OE1 3.42Å; R2106-E2213 VanDerWaalsContact CZ-OE1 3.31Å; R2106-E2213 IonicContact NE-OE1 3.98Å; R2106-E2213 PolarHBondContact NE-OE1 3.25Å; R2106-E2213 IonicContact NH2-OE1 3.59Å; R2106-E2213 PolarHBondContact NH2-OE1 2.91Å
2107	D	75.6	Confident	81.8	Confident	39 Å²	39	57.6 Å²	57.6	21%	0.209	30%	0.299	C	S	.	.			trans	-68.8	125.1	173.6	170.4	30.5	0	0	0	110.6	K395 R2109 T2110 G2111 A2112	K395-D2107 IonicContact NZ-OD1 2.91Å; K395-D2107 PolarHBondContact NZ-OD1 3.38Å; D2107-R2109 PolarHBondContact O-N 3.44Å; D2107-R2109 VanDerWaalsContact O-N 3.07Å; D2107-R2109 PolarHBondContact OD1-N 3.24Å; D2107-T2110 WeakPolarHBondContact CB-OG1 3.36Å; D2107-T2110 PolarHBondContact O-N 2.95Å; D2107-T2110 WeakPolarHBondContact OD2-CG2 3.49Å; D2107-T2110 PolarHBondContact OD2-N 2.89Å; D2107-T2110 PolarHBondContact OD2-OG1 3.34Å; D2107-G2111 WeakPolarHBondContact O-CA 3.12Å; D2107-G2111 PolarHBondContact O-N 3.46Å; D2107-A2112 PolarHBondContact N-O 2.89Å
2108	T	71.5	Confident	81.1	Confident	117 Å²	117	65 Å²	65	72%	0.718	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.6	-177.2	71.3	0	0	0	0	114.1	K395 R2106	K395-T2108 WeakPolarHBondContact CE-OG1 3.4Å; K395-T2108 PolarHBondContact NZ-OG1 2.95Å; K395-T2108 VanDerWaalsContact NZ-OG1 3.15Å; R2106-T2108 PolarHBondContact O-N 3.44Å
2109	R	71.7	Confident	80.8	Confident	216 Å²	216	71.9 Å²	71.9	82%	0.815	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-38.4	-178.8	-166.4	-178.1	67	152.6	2	112.4	D2107	D2107-R2109 PolarHBondContact O-N 3.44Å; D2107-R2109 VanDerWaalsContact O-N 3.07Å; D2107-R2109 PolarHBondContact OD1-N 3.24Å
2110	T	73.6	Confident	80.4	Confident	85 Å²	85	72.1 Å²	72.1	52%	0.521	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-17.8	-172.7	58.4	0	0	0	0	114	D2107 A2112	D2107-T2110 WeakPolarHBondContact CB-OG1 3.36Å; D2107-T2110 PolarHBondContact O-N 2.95Å; D2107-T2110 WeakPolarHBondContact OD2-CG2 3.49Å; D2107-T2110 PolarHBondContact OD2-N 2.89Å; D2107-T2110 PolarHBondContact OD2-OG1 3.34Å; T2110-A2112 PolarHBondContact O-N 3.45Å
2111	G	67.4	Low	80.1	Confident	42 Å²	42	72 Å²	72	43%	0.433	37%	0.368	S	S	.	.			trans	70.8	0.2	-173.3	0	0	0	0	0	114.5	D2107	D2107-G2111 WeakPolarHBondContact O-CA 3.12Å; D2107-G2111 PolarHBondContact O-N 3.46Å
2112	A	75.3	Confident	80	Confident	54 Å²	54	71.9 Å²	71.9	45%	0.446	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-80.5	151.6	-179.3	0	0	0	0	0	111.7	R2106 D2107 T2110	R2106-A2112 CarbonylContact C-O 3.56Å; R2106-A2112 VanDerWaalsContact CA-O 3.24Å; R2106-A2112 WeakPolarHBondContact CA-O 3.44Å; D2107-A2112 PolarHBondContact N-O 2.89Å; T2110-A2112 PolarHBondContact O-N 3.45Å
2113	Q	78.8	Confident	79.9	Confident	80 Å²	80	73.3 Å²	73.3	37%	0.374	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-67.7	140	177.5	-178.3	-178.7	1.6	0	0	111.8	W2104 T2105	W2104-Q2113 HydrophobicContact CB-CG 4.34Å; W2104-Q2113 VanDerWaalsContact CD2-NE2 3.27Å; W2104-Q2113 HydrophobicContact CE3-CG 4.47Å; T2105-Q2113 CarbonylContact O-C 3.5Å; T2105-Q2113 VanDerWaalsContact O-CA 3.3Å; T2105-Q2113 WeakPolarHBondContact O-CA 3.42Å
2114	I	81.1	Confident	80	Confident	58 Å²	58	71.3 Å²	71.3	30%	0.297	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-82.6	130	174.6	-56.4	-174	0	0	0	109.7	T2105 V2121	T2105-I2114 HydrophobicContact CG2-CB 4.39Å; T2105-I2114 HydrophobicContact CG2-CD1 3.67Å; T2105-I2114 HydrophobicContact CG2-CG1 4.12Å; T2105-I2114 PolarHBondContact O-N 2.98Å; I2114-V2121 HydrophobicContact CG2-CG2 4.12Å; I2114-V2121 PolarHBondContact O-N 2.92Å
2115	I	80.6	Confident	80.1	Confident	111 Å²	111	69.5 Å²	69.5	57%	0.569	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	127.6	-179.4	-56.1	174.1	0	0	0	108.7	R2119	I2115-R2119 CarbonylContact C-O 3.56Å; I2115-R2119 VanDerWaalsContact CA-O 3.29Å; I2115-R2119 WeakPolarHBondContact CA-O 3.3Å; I2115-R2119 WeakPolarHBondContact CG2-O 3.36Å
2116	R	76.8	Confident	80.2	Confident	103 Å²	103	69.3 Å²	69.3	39%	0.389	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.9	172.6	-69.6	-175	-171	160.2	13.1	108.9	N2118 R2119 V2121 E2242 F2267	R2116-N2118 PolarHBondContact O-N 2.77Å; R2116-N2118 VanDerWaalsContact O-N 3.14Å; R2116-R2119 PolarHBondContact N-O 3.31Å; R2116-R2119 PolarHBondContact O-N 2.89Å; R2116-V2121 HydrophobicContact CB-CG2 4.12Å; R2116-V2121 HydrophobicContact CG-CG2 3.71Å; R2116-E2242 IonicContact CZ-OE2 3.42Å; R2116-E2242 IonicContact NH1-OE2 3.58Å; R2116-E2242 IonicContact NH2-OE2 3.85Å; R2116-E2242 PolarHBondContact NH2-OE2 2.87Å; R2116-F2267 HydrophobicContact CB-CD1 4.4Å; R2116-F2267 HydrophobicContact CB-CD2 3.82Å; R2116-F2267 HydrophobicContact CB-CE2 4.1Å; R2116-F2267 HydrophobicContact CB-CG 3.98Å
2117	S	75.5	Confident	80.5	Confident	105 Å²	105	64.6 Å²	64.6	73%	0.734	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	43.1	-178.5	-57.8	0	0	0	0	114.4	R2119	S2117-R2119 PolarHBondContact O-N 2.87Å
2118	N	77.5	Confident	80.9	Confident	158 Å²	158	65.6 Å²	65.6	85%	0.845	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	17.4	-178	-150.2	28.5	0	0	0	115.3	R2116	R2116-N2118 PolarHBondContact O-N 2.77Å; R2116-N2118 VanDerWaalsContact O-N 3.14Å
2119	R	83	Confident	81.1	Confident	144 Å²	144	61.6 Å²	61.6	54%	0.543	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	148.2	173.9	-61.4	-170.1	-174.6	-169.6	2.8	111.2	I2115 R2116 S2117 F2267	I2115-R2119 CarbonylContact C-O 3.56Å; I2115-R2119 VanDerWaalsContact CA-O 3.29Å; I2115-R2119 WeakPolarHBondContact CA-O 3.3Å; I2115-R2119 WeakPolarHBondContact CG2-O 3.36Å; R2116-R2119 PolarHBondContact N-O 3.31Å; R2116-R2119 PolarHBondContact O-N 2.89Å; S2117-R2119 PolarHBondContact O-N 2.87Å; R2119-F2267 HydrophobicContact CB-CB 4.31Å
2120	G	82.2	Confident	81	Confident	10 Å²	10	56.7 Å²	56.7	10%	0.103	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	145.3	177.9	0	0	0	0	0	112.5	A2266 F2267	G2120-A2266 CarbonylContact O-C 3.57Å; G2120-A2266 VanDerWaalsContact O-CA 3.3Å; G2120-A2266 WeakPolarHBondContact O-CA 3.24Å; G2120-F2267 PolarHBondContact O-N 3.31Å
2121	V	86.1	Confident	80.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-89.8	124.3	175.9	-174.9	0	0	0	0	110.3	T2105 I2114 R2116 E2242 F2267	T2105-V2121 VanDerWaalsContact CB-O 3.31Å; T2105-V2121 WeakPolarHBondContact CB-O 3.43Å; T2105-V2121 PolarHBondContact N-O 3.48Å; T2105-V2121 PolarHBondContact OG1-O 2.92Å; I2114-V2121 HydrophobicContact CG2-CG2 4.12Å; I2114-V2121 PolarHBondContact O-N 2.92Å; R2116-V2121 HydrophobicContact CB-CG2 4.12Å; R2116-V2121 HydrophobicContact CG-CG2 3.71Å; V2121-E2242 HydrophobicContact CG1-CG 4.35Å; V2121-F2267 HydrophobicContact CG2-CB 4.5Å
2122	L	88.1	Confident	81.1	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	146.3	-178.2	-165.1	71.6	0	0	0	111.2	T2102 W2104 V2243 V2260 A2266	T2102-L2122 HydrophobicContact CG2-CD2 4.15Å; W2104-L2122 HydrophobicContact CD2-CD1 4.4Å; W2104-L2122 HydrophobicContact CE3-CD1 4.09Å; W2104-L2122 HydrophobicContact CZ3-CD1 4.25Å; L2122-V2243 HydrophobicContact CB-CB 4.27Å; L2122-V2243 HydrophobicContact CB-CG2 3.91Å; L2122-V2243 HydrophobicContact CD2-CG2 4.25Å; L2122-V2243 HydrophobicContact CG-CG2 4.3Å; L2122-V2243 WeakPolarHBondContact O-CG2 3.49Å; L2122-V2243 PolarHBondContact O-N 2.94Å; L2122-V2260 HydrophobicContact CD2-CG1 4.07Å; L2122-A2266 HydrophobicContact CB-CB 3.83Å; L2122-A2266 HydrophobicContact CD2-CB 4.49Å
2123	Q	89.1	Confident	81.5	Confident	30 Å²	30	63 Å²	63	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.6	167.5	-59.2	-170.5	-31.3	0	0	110.5	T2102 R2103 T2105 W2240 I2241 E2242	T2102-Q2123 CarbonylContact C-O 3.49Å; T2102-Q2123 VanDerWaalsContact CA-O 3.28Å; T2102-Q2123 WeakPolarHBondContact CA-O 3.37Å; R2103-Q2123 HydrophobicContact CG-CB 4.11Å; R2103-Q2123 PolarHBondContact N-O 2.71Å; R2103-Q2123 VanDerWaalsContact NH2-OE1 3.15Å; R2103-Q2123 PolarHBondContact O-N 3.46Å; T2105-Q2123 HydrophobicContact CG2-CG 4.42Å; T2105-Q2123 VanDerWaalsContact OG1-CG 3.25Å; T2105-Q2123 WeakPolarHBondContact OG1-CG 3.34Å; Q2123-W2240 HydrophobicContact CB-CE3 4.4Å; Q2123-I2241 CarbonylContact C-O 2.93Å; Q2123-I2241 VanDerWaalsContact CA-O 3.23Å; Q2123-I2241 WeakPolarHBondContact CA-O 3.45Å; Q2123-E2242 HydrophobicContact CG-CG 4.38Å
2124	Y	90.6	Very high	81.9	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	156.9	173.2	73.7	-78.8	0	0	0	111.4	I2101 A2126 W2240 I2241 V2243 L2249 L2257	I2101-Y2124 CarbonylContact O-C 3.53Å; I2101-Y2124 WeakPolarHBondContact O-CA 3.37Å; Y2124-A2126 HydrophobicContact CD2-CB 4.22Å; Y2124-A2126 HydrophobicContact CE2-CB 3.65Å; Y2124-W2240 WeakPolarHBondContact O-CA 3.29Å; Y2124-I2241 HydrophobicContact CD1-CB 4.31Å; Y2124-I2241 VanDerWaalsContact CD1-O 3.3Å; Y2124-I2241 WeakPolarHBondContact CD1-O 3.25Å; Y2124-I2241 HydrophobicContact CE1-CB 3.79Å; Y2124-I2241 HydrophobicContact CE1-CG2 3.79Å; Y2124-I2241 PolarHBondContact N-O 3.11Å; Y2124-I2241 PolarHBondContact O-N 2.82Å; Y2124-V2243 HydrophobicContact CD1-CG2 3.82Å; Y2124-V2243 HydrophobicContact CE1-CG2 4.47Å; Y2124-L2249 HydrophobicContact CE2-CD1 4.1Å; Y2124-L2249 HydrophobicContact CE2-CD2 4.42Å; Y2124-L2257 HydrophobicContact CD1-CD1 3.97Å; Y2124-L2257 HydrophobicContact CD1-CD2 3.87Å; Y2124-L2257 HydrophobicContact CD2-CD1 4.38Å; Y2124-L2257 HydrophobicContact CE1-CD2 3.57Å; Y2124-L2257 HydrophobicContact CE2-CD2 4.35Å; Y2124-L2257 HydrophobicContact CG-CD1 3.9Å; Y2124-L2257 HydrophobicContact CG-CD2 4.39Å
2125	L	90.8	Very high	82.3	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123	174.9	-173	154.4	0	0	0	110.1	I2101 P2136 I2225 L2226 L2229 W2240	I2101-L2125 HydrophobicContact CB-CB 4.04Å; I2101-L2125 HydrophobicContact CD1-CD1 4.07Å; I2101-L2125 PolarHBondContact O-N 3.38Å; L2125-P2136 HydrophobicContact CD2-CG 3.78Å; L2125-I2225 HydrophobicContact CD1-CG2 4.09Å; L2125-L2226 HydrophobicContact CD1-CD2 3.63Å; L2125-L2226 HydrophobicContact CD1-CG 4.48Å; L2125-L2226 HydrophobicContact CG-CD2 3.91Å; L2125-L2229 HydrophobicContact CD1-CD1 3.84Å; L2125-L2229 HydrophobicContact CD2-CD1 3.52Å; L2125-L2229 HydrophobicContact CG-CD1 4.36Å; L2125-W2240 HydrophobicContact CB-CE3 4.24Å; L2125-W2240 HydrophobicContact CB-CZ3 4.09Å
2126	A	88.9	Confident	82.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	151.3	176.5	0	0	0	0	0	111.5	Y2124 L2133 S2238 K2239 I2241	Y2124-A2126 HydrophobicContact CD2-CB 4.22Å; Y2124-A2126 HydrophobicContact CE2-CB 3.65Å; A2126-L2133 HydrophobicContact CB-CB 4.49Å; A2126-L2133 HydrophobicContact CB-CD2 4.23Å; A2126-S2238 WeakPolarHBondContact O-CA 3.42Å; A2126-K2239 PolarHBondContact N-O 3.32Å; A2126-K2239 PolarHBondContact O-N 3.06Å; A2126-I2241 HydrophobicContact CB-CD1 3.6Å; A2126-I2241 HydrophobicContact CB-CG1 4.23Å
2127	L	87.4	Confident	83.3	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	124	164.5	-60.2	169.4	0	0	0	108.3	R1973 F1977 L2133 C2134 P2136 Q2237	R1973-L2127 VanDerWaalsContact NH2-CD1 3.3Å; F1977-L2127 HydrophobicContact CD1-CB 4.14Å; F1977-L2127 HydrophobicContact CE1-CB 3.73Å; F1977-L2127 HydrophobicContact CZ-CB 4.42Å; F1977-L2127 VanDerWaalsContact CZ-O 3.28Å; F1977-L2127 WeakPolarHBondContact CZ-O 3.41Å; L2127-L2133 WeakPolarHBondContact O-CA 3.49Å; L2127-C2134 PolarHBondContact N-O 3.24Å; L2127-C2134 PolarHBondContact O-N 3.23Å; L2127-P2136 HydrophobicContact CD1-CB 4.34Å; L2127-P2136 HydrophobicContact CD1-CG 4.39Å; L2127-P2136 HydrophobicContact CG-CG 4.34Å; L2127-Q2237 CarbonylContact C-O 2.91Å
2128	E	83.8	Confident	83.9	Confident	61 Å²	61	42.2 Å²	42.2	29%	0.285	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.7	-178.6	-177.3	176.1	-173.1	0	0	110.6	L2133 Q2237	E2128-L2133 HydrophobicContact CB-CD2 3.77Å; E2128-L2133 HydrophobicContact CG-CD2 3.95Å; E2128-Q2237 PolarHBondContact N-O 3.44Å; E2128-Q2237 PolarHBondContact O-N 2.81Å
2129	R	74.4	Confident	84.4	Confident	32 Å²	32	35 Å²	35	12%	0.121	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	127.7	171.8	174.1	174.2	160.4	70.3	-6.2	109.9	P1976 F1977 N1978 K2131 R2132 E2235 E2236	P1976-R2129 VanDerWaalsContact CB-NE 3.33Å; F1977-R2129 HydrophobicContact CE1-CB 3.66Å; F1977-R2129 HydrophobicContact CZ-CB 3.72Å; N1978-R2129 PolarHBondContact ND2-O 3.38Å; N1978-R2129 WeakPolarHBondContact OD1-CD 3.42Å; N1978-R2129 PolarHBondContact OD1-NE 3.02Å; R2129-K2131 VanDerWaalsContact C-N 3.29Å; R2129-K2131 PolarHBondContact O-N 2.89Å; R2129-R2132 PolarHBondContact N-O 3.38Å; R2129-R2132 PolarHBondContact O-N 2.88Å; R2129-E2235 IonicContact CZ-OE2 3.1Å; R2129-E2235 IonicContact NH1-OE2 3.57Å; R2129-E2235 PolarHBondContact NH1-OE2 2.79Å; R2129-E2236 HydrophobicContact CB-CG 4.45Å
2130	N	70.8	Confident	84.6	Confident	113 Å²	113	28.3 Å²	28.3	60%	0.604	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	45.7	177.3	-62.7	-15.5	0	0	0	113.5	R2132	N2130-R2132 PolarHBondContact O-N 3.3Å; N2130-R2132 VanDerWaalsContact O-N 3.07Å
2131	K	69.2	Low	84.7	Confident	162 Å²	162	28.6 Å²	28.6	70%	0.704	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	6.6	-175.6	-54.9	-176	179.5	-178.3	0	115.7	R2129 N2248	R2129-K2131 VanDerWaalsContact C-N 3.29Å; R2129-K2131 PolarHBondContact O-N 2.89Å; K2131-N2248 VanDerWaalsContact O-CB 3.26Å; K2131-N2248 WeakPolarHBondContact O-CB 3.29Å; K2131-N2248 PolarHBondContact O-ND2 3.1Å
2132	R	73.6	Confident	84.6	Confident	133 Å²	133	28.8 Å²	28.8	50%	0.502	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	140.8	170.6	-64.6	-168.9	177.7	-170.7	0.4	110	R2129 N2130	R2129-R2132 PolarHBondContact N-O 3.38Å; R2129-R2132 PolarHBondContact O-N 2.88Å; N2130-R2132 PolarHBondContact O-N 3.3Å; N2130-R2132 VanDerWaalsContact O-N 3.07Å
2133	L	84.1	Confident	84.2	Confident	19 Å²	19	30.1 Å²	30.1	10%	0.099	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	141.7	-177.7	-61.2	168.2	0	0	0	109.8	A2126 L2127 E2128 I2241 N2248 L2249 R2250	A2126-L2133 HydrophobicContact CB-CB 4.49Å; A2126-L2133 HydrophobicContact CB-CD2 4.23Å; L2127-L2133 WeakPolarHBondContact O-CA 3.49Å; E2128-L2133 HydrophobicContact CB-CD2 3.77Å; E2128-L2133 HydrophobicContact CG-CD2 3.95Å; L2133-I2241 HydrophobicContact CD1-CD1 3.53Å; L2133-I2241 HydrophobicContact CD2-CD1 3.31Å; L2133-I2241 HydrophobicContact CG-CD1 4Å; L2133-N2248 PolarHBondContact N-O 3.36Å; L2133-L2249 HydrophobicContact CB-CD1 3.96Å; L2133-L2249 CarbonylContact O-C 3.36Å; L2133-L2249 WeakPolarHBondContact O-CA 3.27Å; L2133-R2250 PolarHBondContact O-N 3.09Å
2134	C	85.8	Confident	83.4	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.007	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.9	166.6	75.9	0	0	0	0	111.5	F1977 L2127 R2250	F1977-C2134 HydrophobicContact CD2-CB 3.92Å; F1977-C2134 WeakPolarHBondContact CD2-SG 3.33Å; F1977-C2134 HydrophobicContact CE2-CB 3.85Å; F1977-C2134 VanDerWaalsContact CE2-SG 3.51Å; F1977-C2134 WeakPolarHBondContact CG-SG 3.3Å; F1977-C2134 HydrophobicContact CZ-CB 4.45Å; L2127-C2134 PolarHBondContact N-O 3.24Å; L2127-C2134 PolarHBondContact O-N 3.23Å; C2134-R2250 HydrophobicContact CB-CB 4.39Å
2135	M	89.2	Confident	82.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.192	C	C	.	.			trans	-76.4	147.8	167.3	-71.5	-171.1	-87.6	0	0	109.8	V2098 C2100 W2137 H2253 I2256	V2098-M2135 HydrophobicContact CG1-CB 3.9Å; C2100-M2135 HydrophobicContact CB-SD 3.98Å; M2135-W2137 PolarHBondContact O-N 2.84Å; M2135-H2253 HydrophobicContact CE-CB 3.54Å; M2135-H2253 VanDerWaalsContact CE-O 3.23Å; M2135-H2253 WeakPolarHBondContact CE-O 3.46Å; M2135-H2253 PolarHBondContact N-ND1 3.39Å; M2135-H2253 PolarHBondContact O-CE1 3.01Å; M2135-I2256 HydrophobicContact CE-CB 3.78Å; M2135-I2256 HydrophobicContact CE-CD1 4.44Å; M2135-I2256 HydrophobicContact CE-CG2 3.72Å
2136	P	88.5	Confident	81.9	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	20%	0.197	C	C	.	.			trans	-58.1	126	174.8	-18.2	27	0	0	0	112	L2099 L2125 L2127 L2229	L2099-P2136 PolarHBondContact N-O 2.84Å; L2125-P2136 HydrophobicContact CD2-CG 3.78Å; L2127-P2136 HydrophobicContact CD1-CB 4.34Å; L2127-P2136 HydrophobicContact CD1-CG 4.39Å; L2127-P2136 HydrophobicContact CG-CG 4.34Å; P2136-L2229 HydrophobicContact CB-CD1 4.49Å; P2136-L2229 HydrophobicContact CB-CD2 4.27Å; P2136-L2229 HydrophobicContact CG-CD1 3.83Å; P2136-L2229 HydrophobicContact CG-CD2 4.48Å
2137	W	89.7	Confident	81.1	Confident	18 Å²	18	46.7 Å²	46.7	7%	0.068	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	153.9	-178.8	69.8	-81.6	0	0	0	111.5	M1974 F2097 V2098 M2135 L2139 L2197 M2204 H2253	M1974-W2137 HydrophobicContact CG-CH2 4.34Å; M1974-W2137 HydrophobicContact SD-CH2 3.73Å; M1974-W2137 HydrophobicContact SD-CZ2 4.32Å; F2097-W2137 VanDerWaalsContact O-CA 3.28Å; F2097-W2137 WeakPolarHBondContact O-CA 3.29Å; V2098-W2137 HydrophobicContact CG2-CB 3.91Å; M2135-W2137 PolarHBondContact O-N 2.84Å; W2137-L2139 HydrophobicContact CZ3-CD1 4.39Å; W2137-L2139 HydrophobicContact CZ3-CD2 4.34Å; W2137-L2139 HydrophobicContact CZ3-CG 3.96Å; W2137-L2197 HydrophobicContact CH2-CD1 4.05Å; W2137-M2204 HydrophobicContact CH2-SD 4.49Å; W2137-M2204 HydrophobicContact CZ3-SD 4.05Å; W2137-H2253 AromaticContact CD1-CE1 3.94Å
2138	Y	89.6	Confident	80.6	Confident	1 Å²	1	47.4 Å²	47.4	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	142.1	-176.6	-57.7	-95.7	0	0	0	111.6	L1971 W1972 R1973 S2096 F2097 L2159	L1971-Y2138 HydrophobicContact CD1-CD1 4.19Å; L1971-Y2138 HydrophobicContact CD1-CG 3.92Å; L1971-Y2138 HydrophobicContact CD2-CD1 3.64Å; L1971-Y2138 HydrophobicContact CD2-CE1 4.11Å; L1971-Y2138 HydrophobicContact CD2-CG 4.06Å; L1971-Y2138 HydrophobicContact CG-CD1 3.83Å; L1971-Y2138 HydrophobicContact CG-CG 4.09Å; W1972-Y2138 WeakPolarHBondContact O-CA 3.37Å; R1973-Y2138 HydrophobicContact CB-CD1 3.99Å; R1973-Y2138 HydrophobicContact CB-CE1 4.17Å; S2096-Y2138 CarbonylContact C-O 3.49Å; S2096-Y2138 WeakPolarHBondContact CA-O 3.47Å; S2096-Y2138 WeakPolarHBondContact CB-O 3.11Å; F2097-Y2138 HydrophobicContact CD2-CD2 4.26Å; F2097-Y2138 HydrophobicContact CE1-CD2 4.41Å; F2097-Y2138 HydrophobicContact CE1-CG 4.42Å; F2097-Y2138 AromaticContact CE2-CD2 3.41Å; F2097-Y2138 HydrophobicContact CE2-CD2 3.41Å; F2097-Y2138 VanDerWaalsContact CE2-CD2 3.41Å; F2097-Y2138 HydrophobicContact CE2-CE2 4.11Å; F2097-Y2138 HydrophobicContact CE2-CG 4.19Å; F2097-Y2138 AromaticContact CZ-CD2 3.5Å; F2097-Y2138 HydrophobicContact CZ-CD2 3.5Å; F2097-Y2138 HydrophobicContact CZ-CE2 4.33Å; F2097-Y2138 AromaticContact CZ-CG 3.85Å; F2097-Y2138 HydrophobicContact CZ-CG 3.85Å; F2097-Y2138 PolarHBondContact N-O 3.34Å; F2097-Y2138 PolarHBondContact O-N 3.02Å; Y2138-L2159 HydrophobicContact CE1-CD2 4.43Å; Y2138-L2159 HydrophobicContact CE2-CD2 4Å
2139	L	87.9	Confident	80.2	Confident	6 Å²	6	47.6 Å²	47.6	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	145.3	170.5	-65.7	159.8	0	0	0	110.1	L1971 W1972 P2089 N2094 H2095 W2137 M2204	L1971-L2139 CarbonylContact C-O 3.56Å; L1971-L2139 WeakPolarHBondContact CA-O 3.45Å; W1972-L2139 HydrophobicContact CB-CB 4.04Å; W1972-L2139 HydrophobicContact CG-CB 4.34Å; W1972-L2139 PolarHBondContact N-O 3.15Å; W1972-L2139 PolarHBondContact O-N 2.98Å; P2089-L2139 HydrophobicContact CG-CD1 4.19Å; N2094-L2139 HydrophobicContact CB-CD2 4.09Å; H2095-L2139 CarbonylContact O-C 3.6Å; H2095-L2139 WeakPolarHBondContact O-CA 3.49Å; W2137-L2139 HydrophobicContact CZ3-CD1 4.39Å; W2137-L2139 HydrophobicContact CZ3-CD2 4.34Å; W2137-L2139 HydrophobicContact CZ3-CG 3.96Å; L2139-M2204 HydrophobicContact CD2-SD 4.37Å
2140	T	87.2	Confident	80.4	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132.2	-175.5	48.8	0	0	0	0	112.7	R1970 L1971 H2095 F2097 H2142 I2155	R1970-T2140 WeakPolarHBondContact O-CA 3.1Å; L1971-T2140 HydrophobicContact CD1-CG2 3.51Å; H2095-T2140 PolarHBondContact O-N 3.23Å; F2097-T2140 HydrophobicContact CD1-CG2 3.64Å; F2097-T2140 HydrophobicContact CE1-CG2 3.64Å; T2140-H2142 PolarHBondContact OG1-NE2 3.29Å; T2140-I2155 HydrophobicContact CG2-CD1 4.25Å
2141	D	84.8	Confident	81	Confident	16 Å²	16	46.5 Å²	46.5	9%	0.086	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.6	168.4	-69.8	-12.7	0	0	0	110.4	H1969 R1970 L2055 R2090	H1969-D2141 PolarHBondContact ND1-O 3.13Å; R1970-D2141 HydrophobicContact CB-CB 4.27Å; R1970-D2141 IonicContact CZ-OD2 3.83Å; R1970-D2141 IonicContact NE-OD2 3.67Å; R1970-D2141 PolarHBondContact NE-OD2 3.26Å; R1970-D2141 IonicContact NH2-OD2 3.06Å; R1970-D2141 PolarHBondContact NH2-OD2 2.81Å; R1970-D2141 PolarHBondContact O-N 2.91Å; L2055-D2141 HydrophobicContact CD1-CB 3.8Å; R2090-D2141 IonicContact NH2-OD2 3.54Å
2142	H	83.5	Confident	81.7	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.019	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-100.4	137.5	176.5	-64.3	-75.3	0	0	0	111.7	R2056 H2095 T2140 C2146 F2148 C2151	R2056-H2142 WeakPolarHBondContact CB-O 3.24Å; R2056-H2142 PolarHBondContact N-O 3.32Å; R2056-H2142 VanDerWaalsContact N-O 3.14Å; H2095-H2142 AromaticContact CG-CD2 3.9Å; T2140-H2142 PolarHBondContact OG1-NE2 3.29Å; H2142-C2146 HydrophobicContact CB-CB 4.35Å; H2142-F2148 HydrophobicContact CB-CE1 4.39Å; H2142-F2148 AromaticContact CD2-CD1 3.62Å; H2142-F2148 AromaticContact CD2-CE1 3.65Å; H2142-F2148 AromaticContact NE2-CD1 3.75Å; H2142-C2151 PolarHBondContact ND1-SG 3.37Å
2143	T	78.4	Confident	82.1	Confident	29 Å²	29	36.8 Å²	36.8	18%	0.178	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-83.2	172.6	173	65.8	0	0	0	0	111.2	D1968 K2145 C2146	D1968-T2143 HydrophobicContact CB-CG2 4.04Å; D1968-T2143 WeakPolarHBondContact O-CG2 3.45Å; T2143-K2145 PolarHBondContact O-N 2.89Å; T2143-K2145 VanDerWaalsContact O-N 3.13Å; T2143-C2146 PolarHBondContact O-N 3.03Å; T2143-C2146 PolarHBondContact OG1-SG 3.42Å
2144	S	73.9	Confident	82.1	Confident	73 Å²	73	42.3 Å²	42.3	51%	0.51	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.2	-179.4	56.6	0	0	0	0	114.8
2145	K	74	Confident	82	Confident	177 Å²	177	42.5 Å²	42.5	77%	0.77	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-1	-177	-65.3	-177.1	-179.4	176.4	0	114.4	T2143	T2143-K2145 PolarHBondContact O-N 2.89Å; T2143-K2145 VanDerWaalsContact O-N 3.13Å
2146	C	74.4	Confident	81.9	Confident	16 Å²	16	43 Å²	43	11%	0.108	22%	0.217	C	C	.	.			trans	-100.6	127.3	-169.8	-67	0	0	0	0	112.9	H1969 R2056 H2142 T2143 F2148 C2151	H1969-C2146 PolarHBondContact CE1-SG 2.96Å; H1969-C2146 PolarHBondContact NE2-SG 3.23Å; R2056-C2146 PolarHBondContact NH1-O 3.03Å; H2142-C2146 HydrophobicContact CB-CB 4.35Å; T2143-C2146 PolarHBondContact O-N 3.03Å; T2143-C2146 PolarHBondContact OG1-SG 3.42Å; C2146-F2148 VanDerWaalsContact C-N 3.26Å; C2146-F2148 PolarHBondContact O-N 3.45Å; C2146-C2151 HydrophobicContact CB-CB 3.95Å
2147	D	73.5	Confident	81.7	Confident	113 Å²	113	46.4 Å²	46.4	60%	0.604	24%	0.241	S	C	*	.			trans	-86.9	17.4	-178.4	-66.4	-24.8	0	0	0	114.1	D2149	D2147-D2149 PolarHBondContact O-N 3.22Å
2148	F	75.8	Confident	81.4	Confident	17 Å²	17	47.4 Å²	47.4	8%	0.075	25%	0.25	C	S	.	.	S	Bend	trans	59.6	-53.3	-172.4	-55.6	-82.3	0	0	0	114.6	L2060 H2095 H2142 C2146 C2151 V2152	L2060-F2148 HydrophobicContact CD2-CB 4.44Å; L2060-F2148 HydrophobicContact CD2-CD1 3.9Å; L2060-F2148 HydrophobicContact CD2-CD2 3.64Å; L2060-F2148 HydrophobicContact CD2-CE1 3.95Å; L2060-F2148 HydrophobicContact CD2-CE2 3.67Å; L2060-F2148 HydrophobicContact CD2-CG 3.74Å; L2060-F2148 HydrophobicContact CD2-CZ 3.83Å; H2095-F2148 AromaticContact CD2-CE1 3.61Å; H2095-F2148 AromaticContact CE1-CE1 3.85Å; H2095-F2148 AromaticContact NE2-CE1 3.43Å; H2095-F2148 WeakPolarHBondContact NE2-CE1 3.33Å; H2095-F2148 AromaticContact NE2-CZ 3.8Å; H2142-F2148 HydrophobicContact CB-CE1 4.39Å; H2142-F2148 AromaticContact CD2-CD1 3.62Å; H2142-F2148 AromaticContact CD2-CE1 3.65Å; H2142-F2148 AromaticContact NE2-CD1 3.75Å; C2146-F2148 VanDerWaalsContact C-N 3.26Å; C2146-F2148 PolarHBondContact O-N 3.45Å; F2148-C2151 PolarHBondContact O-N 3.4Å; F2148-V2152 VanDerWaalsContact O-CG2 3.23Å; F2148-V2152 WeakPolarHBondContact O-CG2 3.4Å; F2148-V2152 PolarHBondContact O-N 3.47Å
2149	D	76.2	Confident	81.1	Confident	66 Å²	66	47.7 Å²	47.7	35%	0.353	25%	0.252	S	S	.	.	H	α-helix	trans	-69.8	-54.3	-170.8	-61.6	-32.2	0	0	0	112.4	D2147 C2151 K2190	D2147-D2149 PolarHBondContact O-N 3.22Å; D2149-C2151 VanDerWaalsContact C-N 3.28Å; D2149-C2151 PolarHBondContact O-N 2.74Å; D2149-K2190 IonicContact OD1-NZ 2.81Å; D2149-K2190 PolarHBondContact OD1-NZ 2.83Å; D2149-K2190 IonicContact OD2-NZ 3.7Å; D2149-K2190 PolarHBondContact OD2-NZ 2.86Å
2150	E	78.8	Confident	81	Confident	114 Å²	114	48.6 Å²	48.6	53%	0.533	26%	0.257	S	S	.	.	H	α-helix	trans	-67.3	-32.7	175.3	-70.9	-163.8	-176.4	0	0	112.8	K2154	E2150-K2154 WeakPolarHBondContact O-CG 3.12Å; E2150-K2154 PolarHBondContact O-N 2.85Å; E2150-K2154 VanDerWaalsContact O-N 3.14Å; E2150-K2154 IonicContact OE2-NZ 2.8Å; E2150-K2154 PolarHBondContact OE2-NZ 3.47Å
2151	C	83.2	Confident	80.8	Confident	8 Å²	8	50.5 Å²	50.5	5%	0.054	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-47.8	-175.4	-178.5	0	0	0	0	111.1	H1969 H2142 C2146 F2148 D2149 L2153 K2154 I2155	H1969-C2151 PolarHBondContact CE1-SG 2.87Å; H1969-C2151 PolarHBondContact NE2-SG 3.31Å; H2142-C2151 PolarHBondContact ND1-SG 3.37Å; C2146-C2151 HydrophobicContact CB-CB 3.95Å; F2148-C2151 PolarHBondContact O-N 3.4Å; D2149-C2151 VanDerWaalsContact C-N 3.28Å; D2149-C2151 PolarHBondContact O-N 2.74Å; C2151-L2153 PolarHBondContact O-N 3.07Å; C2151-K2154 PolarHBondContact O-N 2.94Å; C2151-I2155 VanDerWaalsContact O-CG1 3.22Å; C2151-I2155 WeakPolarHBondContact O-CG1 3.26Å; C2151-I2155 PolarHBondContact O-N 3.41Å
2152	V	83.2	Confident	80.7	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-40	-178.6	172.7	0	0	0	0	111.2	F2097 F2148 K2154 I2155 I2156 V2207 I2209	F2097-V2152 HydrophobicContact CB-CG1 3.73Å; F2097-V2152 HydrophobicContact CD1-CG1 4.23Å; F2097-V2152 HydrophobicContact CG-CG1 4.01Å; F2148-V2152 VanDerWaalsContact O-CG2 3.23Å; F2148-V2152 WeakPolarHBondContact O-CG2 3.4Å; F2148-V2152 PolarHBondContact O-N 3.47Å; V2152-K2154 PolarHBondContact O-N 3.23Å; V2152-I2155 PolarHBondContact O-N 2.8Å; V2152-I2156 HydrophobicContact CG1-CD1 3.82Å; V2152-I2156 HydrophobicContact CG1-CG1 4.41Å; V2152-I2156 WeakPolarHBondContact O-CG1 3.47Å; V2152-I2156 PolarHBondContact O-N 2.9Å; V2152-V2207 HydrophobicContact CG1-CB 4.5Å; V2152-V2207 HydrophobicContact CG1-CG1 4.42Å; V2152-V2207 HydrophobicContact CG2-CB 4.47Å; V2152-V2207 HydrophobicContact CG2-CG2 4.39Å; V2152-I2209 HydrophobicContact CG1-CD1 3.69Å
2153	L	83.1	Confident	80.6	Confident	89 Å²	89	53.9 Å²	53.9	47%	0.466	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-42.1	175.8	-72.3	170.4	0	0	0	112.3	C2151 I2156 S2157 V2185 I2209	C2151-L2153 PolarHBondContact O-N 3.07Å; L2153-I2156 PolarHBondContact O-N 2.72Å; L2153-S2157 WeakPolarHBondContact O-CB 3.32Å; L2153-S2157 PolarHBondContact O-N 2.85Å; L2153-V2185 HydrophobicContact CD2-CG1 4.26Å; L2153-I2209 HydrophobicContact CD2-CD1 3.88Å; L2153-I2209 HydrophobicContact CG-CD1 4.43Å
2154	K	82.9	Confident	80.8	Confident	136 Å²	136	52.5 Å²	52.5	59%	0.591	27%	0.272	S	S	*	.	H	α-helix	trans	-63	-40.9	174.1	-74.4	167.5	179.4	158.7	0	111.4	E2150 C2151 V2152 S2158	E2150-K2154 WeakPolarHBondContact O-CG 3.12Å; E2150-K2154 PolarHBondContact O-N 2.85Å; E2150-K2154 VanDerWaalsContact O-N 3.14Å; E2150-K2154 IonicContact OE2-NZ 2.8Å; E2150-K2154 PolarHBondContact OE2-NZ 3.47Å; C2151-K2154 PolarHBondContact O-N 2.94Å; V2152-K2154 PolarHBondContact O-N 3.23Å; K2154-S2158 VanDerWaalsContact O-CB 3.28Å; K2154-S2158 WeakPolarHBondContact O-CB 3.35Å; K2154-S2158 PolarHBondContact O-N 3.07Å
2155	I	85	Confident	81.2	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-47.9	176.3	-68.1	163.9	0	0	0	110.9	L1966 H1969 L1971 F2097 T2140 C2151 V2152 S2158 L2159	L1966-I2155 HydrophobicContact CD1-CG2 4.13Å; H1969-I2155 HydrophobicContact CB-CD1 3.92Å; H1969-I2155 HydrophobicContact CB-CG1 4.17Å; L1971-I2155 HydrophobicContact CD1-CG2 4.18Å; F2097-I2155 HydrophobicContact CE1-CG2 3.82Å; F2097-I2155 HydrophobicContact CZ-CG2 4.24Å; T2140-I2155 HydrophobicContact CG2-CD1 4.25Å; C2151-I2155 VanDerWaalsContact O-CG1 3.22Å; C2151-I2155 WeakPolarHBondContact O-CG1 3.26Å; C2151-I2155 PolarHBondContact O-N 3.41Å; V2152-I2155 PolarHBondContact O-N 2.8Å; I2155-S2158 PolarHBondContact O-N 2.74Å; I2155-L2159 VanDerWaalsContact O-CB 3.28Å; I2155-L2159 WeakPolarHBondContact O-CB 3.31Å; I2155-L2159 PolarHBondContact O-N 2.74Å
2156	I	85.6	Confident	81.2	Confident	11 Å²	11	47.9 Å²	47.9	6%	0.056	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-44.9	179.8	-69.1	167.8	0	0	0	111	F2097 L2099 V2152 L2153 S2158 L2159 I2160 I2209	F2097-I2156 HydrophobicContact CD2-CD1 3.93Å; F2097-I2156 HydrophobicContact CD2-CG1 3.96Å; F2097-I2156 HydrophobicContact CE2-CD1 4.14Å; F2097-I2156 HydrophobicContact CE2-CG1 3.67Å; F2097-I2156 HydrophobicContact CG-CD1 4.49Å; F2097-I2156 HydrophobicContact CZ-CG1 4.03Å; L2099-I2156 HydrophobicContact CD1-CD1 4.45Å; L2099-I2156 HydrophobicContact CD1-CG2 4.26Å; V2152-I2156 HydrophobicContact CG1-CD1 3.82Å; V2152-I2156 HydrophobicContact CG1-CG1 4.41Å; V2152-I2156 WeakPolarHBondContact O-CG1 3.47Å; V2152-I2156 PolarHBondContact O-N 2.9Å; L2153-I2156 PolarHBondContact O-N 2.72Å; I2156-S2158 VanDerWaalsContact C-N 3.35Å; I2156-S2158 PolarHBondContact O-N 3.2Å; I2156-L2159 PolarHBondContact O-N 2.73Å; I2156-I2160 HydrophobicContact CG2-CD1 3.78Å; I2156-I2160 HydrophobicContact CG2-CG1 4.41Å; I2156-I2160 WeakPolarHBondContact O-CG1 3.46Å; I2156-I2160 PolarHBondContact O-N 3.4Å; I2156-I2209 HydrophobicContact CD1-CB 4.39Å; I2156-I2209 HydrophobicContact CD1-CD1 3.39Å; I2156-I2209 HydrophobicContact CD1-CG1 4.44Å
2157	S	84.2	Confident	81.3	Confident	72 Å²	72	52.6 Å²	52.6	50%	0.503	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-44.3	177.2	-176.8	0	0	0	0	111.5	L2153 T2161	L2153-S2157 WeakPolarHBondContact O-CB 3.32Å; L2153-S2157 PolarHBondContact O-N 2.85Å; S2157-T2161 VanDerWaalsContact O-CB 3.27Å; S2157-T2161 WeakPolarHBondContact O-CB 3.44Å; S2157-T2161 PolarHBondContact O-N 2.94Å; S2157-T2161 PolarHBondContact O-OG1 3.42Å
2158	S	83.6	Confident	81.6	Confident	38 Å²	38	47.9 Å²	47.9	27%	0.266	25%	0.25	S	S	.	.	H	α-helix	trans	-65.6	-40.8	176.6	-165.9	0	0	0	0	112.2	L1966 K2154 I2155 I2156 T2161 R2162	L1966-S2158 WeakPolarHBondContact CD2-OG 3.36Å; K2154-S2158 VanDerWaalsContact O-CB 3.28Å; K2154-S2158 WeakPolarHBondContact O-CB 3.35Å; K2154-S2158 PolarHBondContact O-N 3.07Å; I2155-S2158 PolarHBondContact O-N 2.74Å; I2156-S2158 VanDerWaalsContact C-N 3.35Å; I2156-S2158 PolarHBondContact O-N 3.2Å; S2158-T2161 PolarHBondContact O-N 3.47Å; S2158-R2162 WeakPolarHBondContact O-CB 3.32Å; S2158-R2162 WeakPolarHBondContact O-CG 3.42Å; S2158-R2162 PolarHBondContact O-N 2.76Å
2159	L	84.5	Confident	81.8	Confident	8 Å²	8	50.9 Å²	50.9	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-48.8	176.4	179.5	69.3	0	0	0	111.7	L1966 L1971 F2097 Y2138 I2155 I2156 R2163	L1966-L2159 HydrophobicContact CD1-CB 4.1Å; L1966-L2159 HydrophobicContact CD1-CD1 4.16Å; L1971-L2159 HydrophobicContact CD2-CD1 3.83Å; L1971-L2159 HydrophobicContact CD2-CD2 4.09Å; L1971-L2159 HydrophobicContact CD2-CG 4.5Å; F2097-L2159 HydrophobicContact CZ-CD2 4.37Å; Y2138-L2159 HydrophobicContact CE1-CD2 4.43Å; Y2138-L2159 HydrophobicContact CE2-CD2 4Å; I2155-L2159 VanDerWaalsContact O-CB 3.28Å; I2155-L2159 WeakPolarHBondContact O-CB 3.31Å; I2155-L2159 PolarHBondContact O-N 2.74Å; I2156-L2159 PolarHBondContact O-N 2.73Å; L2159-R2163 VanDerWaalsContact O-CB 3.27Å; L2159-R2163 WeakPolarHBondContact O-CB 3.44Å; L2159-R2163 PolarHBondContact O-N 3.07Å
2160	I	84.8	Confident	81.9	Confident	24 Å²	24	54.4 Å²	54.4	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-64.9	-42.7	179	-68.1	172.1	0	0	0	110.5	I2156 G2164 L2177 I2180 L2211 L2228	I2156-I2160 HydrophobicContact CG2-CD1 3.78Å; I2156-I2160 HydrophobicContact CG2-CG1 4.41Å; I2156-I2160 WeakPolarHBondContact O-CG1 3.46Å; I2156-I2160 PolarHBondContact O-N 3.4Å; I2160-G2164 WeakPolarHBondContact O-CA 3.07Å; I2160-G2164 PolarHBondContact O-N 3.47Å; I2160-L2177 HydrophobicContact CG2-CD2 4.27Å; I2160-I2180 HydrophobicContact CG2-CD1 3.73Å; I2160-L2211 HydrophobicContact CD1-CD1 4.31Å; I2160-L2228 HydrophobicContact CG2-CD1 4.33Å
2161	T	84.2	Confident	82	Confident	44 Å²	44	56.5 Å²	56.5	27%	0.27	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-52.2	-178.6	-57.2	0	0	0	0	111	S2157 S2158 R2163 G2164 H2165	S2157-T2161 VanDerWaalsContact O-CB 3.27Å; S2157-T2161 WeakPolarHBondContact O-CB 3.44Å; S2157-T2161 PolarHBondContact O-N 2.94Å; S2157-T2161 PolarHBondContact O-OG1 3.42Å; S2158-T2161 PolarHBondContact O-N 3.47Å; T2161-R2163 PolarHBondContact O-N 3.22Å; T2161-G2164 WeakPolarHBondContact O-CA 3.48Å; T2161-G2164 PolarHBondContact O-N 2.65Å; T2161-G2164 VanDerWaalsContact O-N 3.16Å; T2161-H2165 PolarHBondContact O-CD2 3.48Å; T2161-H2165 PolarHBondContact O-N 3.17Å
2162	R	81.9	Confident	81.9	Confident	74 Å²	74	61.5 Å²	61.5	28%	0.279	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-42.9	179	-70.9	-169.5	-174.9	176.6	-0.5	112.2	D1946 T1965 S2158 G2164 H2165 A2166	D1946-R2162 HydrophobicContact CB-CB 4.37Å; D1946-R2162 WeakPolarHBondContact OD1-CD 3.3Å; D1946-R2162 IonicContact OD1-CZ 2.87Å; D1946-R2162 IonicContact OD1-NE 3.22Å; D1946-R2162 IonicContact OD1-NH1 3.22Å; D1946-R2162 PolarHBondContact OD1-NH1 3.09Å; T1965-R2162 PolarHBondContact O-NH1 3.39Å; S2158-R2162 WeakPolarHBondContact O-CB 3.32Å; S2158-R2162 WeakPolarHBondContact O-CG 3.42Å; S2158-R2162 PolarHBondContact O-N 2.76Å; R2162-G2164 VanDerWaalsContact C-N 3.33Å; R2162-G2164 PolarHBondContact O-N 2.78Å; R2162-H2165 PolarHBondContact O-N 3.01Å; R2162-A2166 WeakPolarHBondContact O-CB 3.28Å; R2162-A2166 PolarHBondContact O-N 3.21Å
2163	R	82	Confident	81.8	Confident	16 Å²	16	61.5 Å²	61.5	6%	0.06	31%	0.311	C	S	.	.	H	α-helix	trans	-67.2	-34	174.3	-80.3	-149.5	144	-173.7	-9.5	113.3	L2159 T2161 A2166 M2167 L2228 N2230 E2231	L2159-R2163 VanDerWaalsContact O-CB 3.27Å; L2159-R2163 WeakPolarHBondContact O-CB 3.44Å; L2159-R2163 PolarHBondContact O-N 3.07Å; T2161-R2163 PolarHBondContact O-N 3.22Å; R2163-A2166 PolarHBondContact O-N 3.34Å; R2163-M2167 WeakPolarHBondContact O-CB 3.11Å; R2163-M2167 PolarHBondContact O-N 2.94Å; R2163-L2228 HydrophobicContact CB-CD2 4.12Å; R2163-L2228 WeakPolarHBondContact CD-O 3.32Å; R2163-L2228 PolarHBondContact NH1-O 3.28Å; R2163-N2230 PolarHBondContact NH1-O 3.38Å; R2163-N2230 PolarHBondContact NH2-O 3.21Å; R2163-E2231 IonicContact CZ-OE2 2.7Å; R2163-E2231 IonicContact NH1-OE1 3.33Å; R2163-E2231 IonicContact NH1-OE2 2.99Å; R2163-E2231 IonicContact NH2-OE1 3.9Å; R2163-E2231 IonicContact NH2-OE2 2.77Å; R2163-E2231 PolarHBondContact NH2-OE2 2.98Å
2164	G	81.2	Confident	81.8	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-54.4	-57.8	171.3	0	0	0	0	0	110.5	I2160 T2161 R2162 A2166 M2167 L2168 V2173	I2160-G2164 WeakPolarHBondContact O-CA 3.07Å; I2160-G2164 PolarHBondContact O-N 3.47Å; T2161-G2164 WeakPolarHBondContact O-CA 3.48Å; T2161-G2164 PolarHBondContact O-N 2.65Å; T2161-G2164 VanDerWaalsContact O-N 3.16Å; R2162-G2164 VanDerWaalsContact C-N 3.33Å; R2162-G2164 PolarHBondContact O-N 2.78Å; G2164-A2166 VanDerWaalsContact C-N 3.28Å; G2164-A2166 PolarHBondContact O-N 3.21Å; G2164-M2167 PolarHBondContact O-N 3.47Å; G2164-L2168 PolarHBondContact O-N 3.38Å; G2164-V2173 WeakPolarHBondContact O-CG2 3Å
2165	H	82.5	Confident	81.8	Confident	98 Å²	98	61.9 Å²	61.9	45%	0.454	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-29.6	179.2	-71.4	-72.7	0	0	0	113.4	T2161 R2162	T2161-H2165 PolarHBondContact O-CD2 3.48Å; T2161-H2165 PolarHBondContact O-N 3.17Å; R2162-H2165 PolarHBondContact O-N 3.01Å
2166	A	75.5	Confident	81.7	Confident	55 Å²	55	61.9 Å²	61.9	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-79	-31.1	178.4	0	0	0	0	0	114.6	R2162 R2163 G2164	R2162-A2166 WeakPolarHBondContact O-CB 3.28Å; R2162-A2166 PolarHBondContact O-N 3.21Å; R2163-A2166 PolarHBondContact O-N 3.34Å; G2164-A2166 VanDerWaalsContact C-N 3.28Å; G2164-A2166 PolarHBondContact O-N 3.21Å
2167	M	76.1	Confident	81.6	Confident	114 Å²	114	63.2 Å²	63.2	56%	0.562	32%	0.315	S	S	*	.	H	α-helix	trans	-114.1	-21	-168.8	-68.2	-80.6	164	0	0	114.8	R2163 G2164 L2228	R2163-M2167 WeakPolarHBondContact O-CB 3.11Å; R2163-M2167 PolarHBondContact O-N 2.94Å; G2164-M2167 PolarHBondContact O-N 3.47Å; M2167-L2228 HydrophobicContact CB-CD2 4.38Å
2168	L	79.1	Confident	81.5	Confident	14 Å²	14	66.1 Å²	66.1	7%	0.073	32%	0.319	C	S	.	.	S	Bend	trans	-122.1	149.7	-174.4	-70.6	164.6	0	0	0	111.2	G2164 R2172 V2173 L2176 D2224 L2228	G2164-L2168 PolarHBondContact O-N 3.38Å; L2168-R2172 HydrophobicContact CB-CB 4.46Å; L2168-V2173 HydrophobicContact CB-CG2 3.65Å; L2168-L2176 HydrophobicContact CD1-CD2 3.67Å; L2168-D2224 HydrophobicContact CD1-CB 4.5Å; L2168-D2224 HydrophobicContact CD2-CB 4.33Å; L2168-L2228 HydrophobicContact CD1-CD2 3.9Å; L2168-L2228 HydrophobicContact CD1-CG 4.32Å; L2168-L2228 HydrophobicContact CG-CD2 4.5Å
2169	P	80.5	Confident	81.5	Confident	80 Å²	80	68.4 Å²	68.4	52%	0.519	32%	0.322	S	S	.	.			trans	-59.3	140.2	170	-17.2	28.1	0	0	0	110.6	K2171 R2172 V2173	P2169-K2171 VanDerWaalsContact C-N 3.27Å; P2169-K2171 PolarHBondContact O-N 3.28Å; P2169-K2171 VanDerWaalsContact O-N 3.09Å; P2169-R2172 HydrophobicContact CG-CG 4.5Å; P2169-R2172 WeakPolarHBondContact O-CA 3.01Å; P2169-R2172 WeakPolarHBondContact O-CB 3.39Å; P2169-R2172 PolarHBondContact O-N 3.32Å; P2169-V2173 PolarHBondContact O-N 3.49Å; P2169-V2173 VanDerWaalsContact O-N 3.11Å
2170	E	78.1	Confident	81.3	Confident	140 Å²	140	69.2 Å²	69.2	65%	0.654	33%	0.326	S	S	*	.	H	α-helix	trans	-45.2	-46.6	-176.8	-160.6	176.7	-162.4	0	0	113.3	R2172 V2173 D2174	E2170-R2172 VanDerWaalsContact C-N 3.25Å; E2170-R2172 PolarHBondContact O-N 3.19Å; E2170-R2172 VanDerWaalsContact O-N 3.14Å; E2170-V2173 WeakPolarHBondContact O-CB 3.21Å; E2170-V2173 PolarHBondContact O-N 3.47Å; E2170-D2174 PolarHBondContact O-N 3.04Å
2171	K	81	Confident	81	Confident	158 Å²	158	75.5 Å²	75.5	69%	0.687	36%	0.355	S	S	*	.	H	α-helix	trans	-60	-26.7	176.2	-68.1	-176.1	-179.8	177.7	0	115.3	P2169 R2175	P2169-K2171 VanDerWaalsContact C-N 3.27Å; P2169-K2171 PolarHBondContact O-N 3.28Å; P2169-K2171 VanDerWaalsContact O-N 3.09Å; K2171-R2175 WeakPolarHBondContact O-CG 3.49Å; K2171-R2175 PolarHBondContact O-NE 2.8Å
2172	R	81.2	Confident	81	Confident	113 Å²	113	78.8 Å²	78.8	43%	0.426	37%	0.365	S	S	.	.	H	α-helix	trans	-86	-34.8	175.1	-68	-165.2	-171.5	-168.3	3.3	110.9	L2168 P2169 E2170 R2175 L2176 D2224	L2168-R2172 HydrophobicContact CB-CB 4.46Å; P2169-R2172 HydrophobicContact CG-CG 4.5Å; P2169-R2172 WeakPolarHBondContact O-CA 3.01Å; P2169-R2172 WeakPolarHBondContact O-CB 3.39Å; P2169-R2172 PolarHBondContact O-N 3.32Å; E2170-R2172 VanDerWaalsContact C-N 3.25Å; E2170-R2172 PolarHBondContact O-N 3.19Å; E2170-R2172 VanDerWaalsContact O-N 3.14Å; R2172-R2175 PolarHBondContact O-N 3.47Å; R2172-L2176 WeakPolarHBondContact O-CB 3.19Å; R2172-L2176 PolarHBondContact O-N 2.75Å; R2172-D2224 IonicContact NH1-OD1 3.95Å; R2172-D2224 PolarHBondContact NH1-OD1 3.39Å
2173	V	80.9	Confident	81	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-58.8	-50.5	174.1	-177.7	0	0	0	0	109.9	G2164 L2168 P2169 E2170 R2175 L2176 L2177	G2164-V2173 WeakPolarHBondContact O-CG2 3Å; L2168-V2173 HydrophobicContact CB-CG2 3.65Å; P2169-V2173 PolarHBondContact O-N 3.49Å; P2169-V2173 VanDerWaalsContact O-N 3.11Å; E2170-V2173 WeakPolarHBondContact O-CB 3.21Å; E2170-V2173 PolarHBondContact O-N 3.47Å; V2173-R2175 VanDerWaalsContact C-N 3.26Å; V2173-R2175 PolarHBondContact O-N 3.27Å; V2173-L2176 PolarHBondContact O-N 2.88Å; V2173-L2177 HydrophobicContact CG1-CD1 3.74Å; V2173-L2177 HydrophobicContact CG1-CG 4.13Å; V2173-L2177 WeakPolarHBondContact O-CB 3.41Å; V2173-L2177 WeakPolarHBondContact O-CG 3.39Å; V2173-L2177 PolarHBondContact O-N 3.26Å
2174	D	83.2	Confident	81.1	Confident	76 Å²	76	78.9 Å²	78.9	41%	0.406	37%	0.372	S	S	.	.	H	α-helix	trans	-58.9	-36.9	178.2	-63.2	-23.1	0	0	0	112.9	E2170 K2178	E2170-D2174 PolarHBondContact O-N 3.04Å; D2174-K2178 VanDerWaalsContact O-CB 3.28Å; D2174-K2178 WeakPolarHBondContact O-CB 3.43Å; D2174-K2178 WeakPolarHBondContact O-CG 3.43Å; D2174-K2178 PolarHBondContact O-N 2.98Å
2175	R	82.9	Confident	81.3	Confident	157 Å²	157	82.4 Å²	82.4	59%	0.592	39%	0.393	S	S	*	.	H	α-helix	trans	-72	-37	177	-70.4	179.7	-144.9	-170.1	-0.2	111.8	K2171 R2172 V2173 R2179	K2171-R2175 WeakPolarHBondContact O-CG 3.49Å; K2171-R2175 PolarHBondContact O-NE 2.8Å; R2172-R2175 PolarHBondContact O-N 3.47Å; V2173-R2175 VanDerWaalsContact C-N 3.26Å; V2173-R2175 PolarHBondContact O-N 3.27Å; R2175-R2179 WeakPolarHBondContact O-CD 3.43Å; R2175-R2179 WeakPolarHBondContact O-CG 3.43Å; R2175-R2179 PolarHBondContact O-N 3.41Å
2176	L	82.9	Confident	81.6	Confident	6 Å²	6	79.2 Å²	79.2	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-71.1	-46.4	179.1	-177.7	59.1	0	0	0	110.3	L2168 R2172 V2173 K2178 R2179 I2180 P2222 L2228	L2168-L2176 HydrophobicContact CD1-CD2 3.67Å; R2172-L2176 WeakPolarHBondContact O-CB 3.19Å; R2172-L2176 PolarHBondContact O-N 2.75Å; V2173-L2176 PolarHBondContact O-N 2.88Å; L2176-K2178 PolarHBondContact O-N 3.1Å; L2176-R2179 WeakPolarHBondContact O-CB 3.26Å; L2176-R2179 PolarHBondContact O-N 2.89Å; L2176-I2180 HydrophobicContact CD1-CD1 4.08Å; L2176-I2180 HydrophobicContact CD1-CG1 4.37Å; L2176-I2180 HydrophobicContact CG-CD1 3.93Å; L2176-I2180 WeakPolarHBondContact O-CG1 3.43Å; L2176-I2180 PolarHBondContact O-N 3.11Å; L2176-P2222 HydrophobicContact CD1-CG 3.91Å; L2176-L2228 HydrophobicContact CD2-CD1 3.46Å; L2176-L2228 VanDerWaalsContact CD2-CD1 3.46Å; L2176-L2228 HydrophobicContact CD2-CG 4.3Å
2177	L	82.6	Confident	82.2	Confident	38 Å²	38	81.5 Å²	81.5	20%	0.199	38%	0.381	C	S	.	.	H	α-helix	trans	-58.1	-47.1	174.1	-69	175.2	0	0	0	111	I2160 V2173 R2179 I2180 E2181	I2160-L2177 HydrophobicContact CG2-CD2 4.27Å; V2173-L2177 HydrophobicContact CG1-CD1 3.74Å; V2173-L2177 HydrophobicContact CG1-CG 4.13Å; V2173-L2177 WeakPolarHBondContact O-CB 3.41Å; V2173-L2177 WeakPolarHBondContact O-CG 3.39Å; V2173-L2177 PolarHBondContact O-N 3.26Å; L2177-R2179 PolarHBondContact O-N 3.03Å; L2177-R2179 VanDerWaalsContact O-N 3.16Å; L2177-I2180 PolarHBondContact O-N 2.84Å; L2177-I2180 VanDerWaalsContact O-N 3.13Å; L2177-E2181 WeakPolarHBondContact O-CB 3.49Å; L2177-E2181 WeakPolarHBondContact O-CG 3.39Å; L2177-E2181 PolarHBondContact O-N 3.47Å
2178	K	83.1	Confident	82.7	Confident	134 Å²	134	78 Å²	78	58%	0.583	36%	0.364	S	S	*	.	H	α-helix	trans	-60.9	-24.7	174	-78.8	176.5	-179	176.2	0	114.9	D2174 L2176 K2182	D2174-K2178 VanDerWaalsContact O-CB 3.28Å; D2174-K2178 WeakPolarHBondContact O-CB 3.43Å; D2174-K2178 WeakPolarHBondContact O-CG 3.43Å; D2174-K2178 PolarHBondContact O-N 2.98Å; L2176-K2178 PolarHBondContact O-N 3.1Å; K2178-K2182 WeakPolarHBondContact O-CD 3.29Å; K2178-K2182 WeakPolarHBondContact O-CG 3.37Å
2179	R	82.6	Confident	83	Confident	86 Å²	86	80.5 Å²	80.5	33%	0.325	38%	0.375	S	S	.	.	H	α-helix	trans	-84.4	-37	175.8	-73.9	171.9	-177.9	-151.2	10.3	111.3	R2175 L2176 L2177 K2182 A2183 G2218 Q2220	R2175-R2179 WeakPolarHBondContact O-CD 3.43Å; R2175-R2179 WeakPolarHBondContact O-CG 3.43Å; R2175-R2179 PolarHBondContact O-N 3.41Å; L2176-R2179 WeakPolarHBondContact O-CB 3.26Å; L2176-R2179 PolarHBondContact O-N 2.89Å; L2177-R2179 PolarHBondContact O-N 3.03Å; L2177-R2179 VanDerWaalsContact O-N 3.16Å; R2179-K2182 CarbonylContact O-C 3.15Å; R2179-K2182 PolarHBondContact O-N 3.15Å; R2179-A2183 PolarHBondContact O-N 2.93Å; R2179-A2183 VanDerWaalsContact O-N 3.11Å; R2179-G2218 WeakPolarHBondContact CG-O 3.48Å; R2179-Q2220 WeakPolarHBondContact CD-O 3.35Å; R2179-Q2220 PolarHBondContact NH1-O 3.37Å
2180	I	80.2	Confident	83.4	Confident	25 Å²	25	80.3 Å²	80.3	13%	0.128	37%	0.366	C	S	.	.	H	α-helix	trans	-69.6	-39.2	176.2	-67.4	172	0	0	0	110.5	I2160 L2176 L2177 K2182 A2183 L2221 I2225	I2160-I2180 HydrophobicContact CG2-CD1 3.73Å; L2176-I2180 HydrophobicContact CD1-CD1 4.08Å; L2176-I2180 HydrophobicContact CD1-CG1 4.37Å; L2176-I2180 HydrophobicContact CG-CD1 3.93Å; L2176-I2180 WeakPolarHBondContact O-CG1 3.43Å; L2176-I2180 PolarHBondContact O-N 3.11Å; L2177-I2180 PolarHBondContact O-N 2.84Å; L2177-I2180 VanDerWaalsContact O-N 3.13Å; I2180-K2182 PolarHBondContact O-N 3.27Å; I2180-K2182 VanDerWaalsContact O-N 3.17Å; I2180-A2183 WeakPolarHBondContact O-CB 3.39Å; I2180-A2183 PolarHBondContact O-N 3.11Å; I2180-L2221 HydrophobicContact CG1-CD2 4.38Å; I2180-I2225 HydrophobicContact CD1-CD1 4.47Å
2181	E	80.4	Confident	84	Confident	155 Å²	155	73.9 Å²	73.9	72%	0.724	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.6	171	-75.6	173.1	177.5	0	0	113.1	L2177	L2177-E2181 WeakPolarHBondContact O-CB 3.49Å; L2177-E2181 WeakPolarHBondContact O-CG 3.39Å; L2177-E2181 PolarHBondContact O-N 3.47Å
2182	K	82.9	Confident	84.5	Confident	113 Å²	113	67.7 Å²	67.7	49%	0.491	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-7.3	175.6	-68.1	178.7	-178.2	-173.7	0	113.6	K2178 R2179 I2180 S2214 A2219	K2178-K2182 WeakPolarHBondContact O-CD 3.29Å; K2178-K2182 WeakPolarHBondContact O-CG 3.37Å; R2179-K2182 CarbonylContact O-C 3.15Å; R2179-K2182 PolarHBondContact O-N 3.15Å; I2180-K2182 PolarHBondContact O-N 3.27Å; I2180-K2182 VanDerWaalsContact O-N 3.17Å; K2182-S2214 WeakPolarHBondContact O-CB 3.24Å; K2182-A2219 HydrophobicContact CB-CB 4.04Å; K2182-A2219 WeakPolarHBondContact O-CB 3.08Å
2183	A	81.2	Confident	84.9	Confident	12 Å²	12	62.9 Å²	62.9	10%	0.099	29%	0.293	C	S	.	.	S	Bend	trans	-76.4	150.9	178.2	0	0	0	0	0	110.2	R2179 I2180	R2179-A2183 PolarHBondContact O-N 2.93Å; R2179-A2183 VanDerWaalsContact O-N 3.11Å; I2180-A2183 WeakPolarHBondContact O-CB 3.39Å; I2180-A2183 PolarHBondContact O-N 3.11Å
2184	E	85	Confident	85.2	Confident	81 Å²	81	68.7 Å²	68.7	38%	0.379	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	123.9	177.7	-166.5	-169.7	143.7	0	0	109.3	T2186 H2212 R2264	E2184-T2186 HydrophobicContact CG-CG2 4.29Å; E2184-H2212 HydrophobicContact CB-CB 4.4Å; E2184-H2212 PolarHBondContact N-O 3.25Å; E2184-H2212 PolarHBondContact O-N 3.32Å; E2184-R2264 VanDerWaalsContact CD-NH1 3.31Å; E2184-R2264 IonicContact OE1-CZ 3.7Å; E2184-R2264 IonicContact OE1-NH1 3.13Å; E2184-R2264 PolarHBondContact OE1-NH1 3.05Å; E2184-R2264 IonicContact OE1-NH2 2.66Å; E2184-R2264 PolarHBondContact OE1-NH2 2.92Å; E2184-R2264 IonicContact OE2-CZ 2.73Å; E2184-R2264 IonicContact OE2-NH1 2.64Å; E2184-R2264 PolarHBondContact OE2-NH1 3.12Å; E2184-R2264 IonicContact OE2-NH2 3.36Å; E2184-R2264 PolarHBondContact OE2-NH2 2.77Å
2185	V	85.9	Confident	85.2	Confident	74 Å²	74	65.4 Å²	65.4	45%	0.448	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.9	-178.3	-171.7	0	0	0	0	109.3	L2153 I2209 N2210 L2211	L2153-V2185 HydrophobicContact CD2-CG1 4.26Å; V2185-I2209 HydrophobicContact CG1-CG2 3.71Å; V2185-N2210 WeakPolarHBondContact CA-O 3.37Å; V2185-L2211 HydrophobicContact CB-CD2 4.2Å; V2185-L2211 HydrophobicContact CG1-CD2 3.92Å; V2185-L2211 HydrophobicContact CG2-CD2 3.55Å
2186	T	87.8	Confident	85	Confident	32 Å²	32	62.5 Å²	62.5	20%	0.196	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	132.3	179.6	62.7	0	0	0	0	111.5	E2184 N2210	E2184-T2186 HydrophobicContact CG-CG2 4.29Å; T2186-N2210 PolarHBondContact N-O 3.39Å; T2186-N2210 WeakPolarHBondContact O-CB 3.5Å; T2186-N2210 PolarHBondContact O-N 2.95Å; T2186-N2210 WeakPolarHBondContact OG1-CB 3.36Å
2187	Q	88.4	Confident	85	Confident	102 Å²	102	62.6 Å²	62.6	48%	0.477	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.5	172	-179.4	179	-28.5	0	0	110	V2207 V2208	Q2187-V2207 HydrophobicContact CG-CG1 4.46Å; Q2187-V2208 WeakPolarHBondContact CA-O 3.4Å
2188	I	86.2	Confident	85.2	Confident	40 Å²	40	60.9 Å²	60.9	21%	0.205	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-45.4	-175.9	-58.9	153.1	0	0	0	111.4	C2100 V2208 N2210 I2256 N2259 V2260	C2100-I2188 HydrophobicContact CB-CD1 4.33Å; I2188-V2208 HydrophobicContact CB-CB 4.31Å; I2188-V2208 HydrophobicContact CB-CG1 4.18Å; I2188-V2208 HydrophobicContact CD1-CG1 3.71Å; I2188-V2208 PolarHBondContact N-O 2.86Å; I2188-N2210 HydrophobicContact CD1-CB 3.76Å; I2188-N2210 HydrophobicContact CG1-CB 4.09Å; I2188-I2256 HydrophobicContact CD1-CG2 4.26Å; I2188-N2259 HydrophobicContact CG2-CB 4.25Å; I2188-V2260 HydrophobicContact CD1-CG2 3.19Å; I2188-V2260 HydrophobicContact CG1-CG2 3.97Å
2189	F	87.3	Confident	85.4	Confident	67 Å²	67	54.5 Å²	54.5	29%	0.294	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	144.9	-169.9	176	-101.2	0	0	0	110.9	Y2192 T2206 V2208	F2189-Y2192 VanDerWaalsContact CZ-O 3.23Å; F2189-Y2192 WeakPolarHBondContact CZ-O 3.36Å; F2189-T2206 HydrophobicContact CD1-CG2 4Å; F2189-T2206 HydrophobicContact CE1-CG2 4.14Å; F2189-V2208 HydrophobicContact CB-CB 4.2Å; F2189-V2208 HydrophobicContact CB-CG2 3.89Å; F2189-V2208 HydrophobicContact CD1-CG2 4.04Å; F2189-V2208 HydrophobicContact CG-CG2 4.47Å; F2189-V2208 PolarHBondContact O-N 3.32Å
2190	K	88.8	Confident	85.6	Confident	76 Å²	76	50.7 Å²	50.7	33%	0.33	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	121.9	173.2	174	176.9	179.1	175.2	0	108.8	L2060 D2149 T2206 V2207	L2060-K2190 HydrophobicContact CD1-CG 4.02Å; D2149-K2190 IonicContact OD1-NZ 2.81Å; D2149-K2190 PolarHBondContact OD1-NZ 2.83Å; D2149-K2190 IonicContact OD2-NZ 3.7Å; D2149-K2190 PolarHBondContact OD2-NZ 2.86Å; K2190-T2206 WeakPolarHBondContact CA-O 3.42Å; K2190-V2207 HydrophobicContact CG-CG2 4.31Å
2191	G	89.2	Confident	86	Confident	5 Å²	5	50 Å²	50	5%	0.052	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.2	-160.5	178	0	0	0	0	0	113.4	L2193 E2205 T2206	G2191-L2193 PolarHBondContact O-N 2.9Å; G2191-E2205 CarbonylContact O-C 3.55Å; G2191-E2205 VanDerWaalsContact O-CA 3.3Å; G2191-E2205 WeakPolarHBondContact O-CA 3.34Å; G2191-T2206 PolarHBondContact N-O 3.35Å; G2191-T2206 VanDerWaalsContact N-O 3.15Å; G2191-T2206 PolarHBondContact O-N 2.85Å
2192	Y	91.7	Very high	86.4	Confident	28 Å²	28	42.7 Å²	42.7	11%	0.11	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	126.8	176	-178.5	-85.6	0	0	0	110.9	N2075 P2076 M2077 F2189 D2194 N2198 W2203	N2075-Y2192 PolarHBondContact ND2-OH 3.05Å; N2075-Y2192 VanDerWaalsContact ND2-OH 3.08Å; N2075-Y2192 VanDerWaalsContact OD1-CE2 3.32Å; N2075-Y2192 WeakPolarHBondContact OD1-CE2 3.44Å; P2076-Y2192 HydrophobicContact CG-CD2 4.41Å; M2077-Y2192 HydrophobicContact CB-CE1 4.16Å; M2077-Y2192 HydrophobicContact CB-CE2 4.25Å; M2077-Y2192 HydrophobicContact CG-CD1 3.58Å; M2077-Y2192 HydrophobicContact CG-CD2 3.85Å; M2077-Y2192 HydrophobicContact CG-CE1 3.45Å; M2077-Y2192 VanDerWaalsContact CG-CE1 3.45Å; M2077-Y2192 HydrophobicContact CG-CE2 3.7Å; M2077-Y2192 HydrophobicContact CG-CG 3.78Å; M2077-Y2192 HydrophobicContact SD-CD1 4.44Å; F2189-Y2192 VanDerWaalsContact CZ-O 3.23Å; F2189-Y2192 WeakPolarHBondContact CZ-O 3.36Å; Y2192-D2194 HydrophobicContact CE1-CB 4.12Å; Y2192-N2198 VanDerWaalsContact CZ-ND2 3.34Å; Y2192-N2198 PolarHBondContact OH-ND2 3.32Å; Y2192-W2203 HydrophobicContact CD2-CB 4.25Å; Y2192-W2203 AromaticContact CD2-CD1 3.59Å; Y2192-W2203 HydrophobicContact CD2-CG 4.08Å; Y2192-W2203 HydrophobicContact CE2-CB 3.58Å; Y2192-W2203 AromaticContact CE2-CD1 3.79Å; Y2192-W2203 AromaticContact CE2-CG 3.78Å; Y2192-W2203 HydrophobicContact CE2-CG 3.78Å
2193	L	89.4	Confident	86.8	Confident	13 Å²	13	37.3 Å²	37.3	7%	0.068	19%	0.189	C	C	.	.			trans	-99.8	115.3	174.3	-174.9	66.9	0	0	0	108.3	G2191 D2195 N2198 M2204 T2206 I2256	G2191-L2193 PolarHBondContact O-N 2.9Å; L2193-D2195 HydrophobicContact CG-CB 4.35Å; L2193-D2195 PolarHBondContact O-N 3.15Å; L2193-D2195 VanDerWaalsContact O-N 3.15Å; L2193-N2198 PolarHBondContact O-ND2 3.35Å; L2193-M2204 HydrophobicContact CD2-CE 4.33Å; L2193-M2204 PolarHBondContact N-O 3Å; L2193-T2206 HydrophobicContact CB-CG2 3.9Å; L2193-T2206 HydrophobicContact CD1-CG2 4.04Å; L2193-T2206 HydrophobicContact CD2-CG2 4.05Å; L2193-T2206 HydrophobicContact CG-CG2 4.22Å; L2193-I2256 HydrophobicContact CD1-CD1 4.23Å
2194	D	87.2	Confident	87.3	Confident	122 Å²	122	36.8 Å²	36.8	65%	0.652	19%	0.185	S	C	*	.			trans	-71.4	110	174.3	-169.7	27.9	0	0	0	109.8	Y2192 S2252	Y2192-D2194 HydrophobicContact CE1-CB 4.12Å; D2194-S2252 VanDerWaalsContact O-CB 3.24Å; D2194-S2252 WeakPolarHBondContact O-CB 3.49Å
2195	D	84.4	Confident	87.6	Confident	7 Å²	7	33 Å²	33	4%	0.037	17%	0.167	C	C	.	.			trans	-147.5	150.6	-167.1	-166.9	-84.4	0	0	0	111.7	L2193 L2197 N2198 M2204 R2250 S2252	L2193-D2195 HydrophobicContact CG-CB 4.35Å; L2193-D2195 PolarHBondContact O-N 3.15Å; L2193-D2195 VanDerWaalsContact O-N 3.15Å; D2195-L2197 PolarHBondContact O-N 3.34Å; D2195-L2197 PolarHBondContact OD1-N 2.88Å; D2195-L2197 VanDerWaalsContact OD1-N 3.11Å; D2195-N2198 PolarHBondContact N-ND2 3.21Å; D2195-N2198 VanDerWaalsContact N-ND2 3.15Å; D2195-N2198 WeakPolarHBondContact O-CB 3.46Å; D2195-N2198 PolarHBondContact O-N 3.2Å; D2195-N2198 PolarHBondContact O-ND2 3Å; D2195-M2204 HydrophobicContact CB-CE 3.39Å; D2195-M2204 VanDerWaalsContact OD1-CE 3.23Å; D2195-M2204 WeakPolarHBondContact OD1-CE 3.36Å; D2195-R2250 VanDerWaalsContact CG-NH2 3.33Å; D2195-R2250 IonicContact OD1-CZ 3.56Å; D2195-R2250 IonicContact OD1-NE 3.62Å; D2195-R2250 IonicContact OD1-NH2 3.78Å; D2195-R2250 PolarHBondContact OD1-NH2 3.38Å; D2195-R2250 IonicContact OD2-CZ 3.19Å; D2195-R2250 IonicContact OD2-NE 2.73Å; D2195-R2250 PolarHBondContact OD2-NE 3.45Å; D2195-R2250 IonicContact OD2-NH2 3.06Å; D2195-R2250 PolarHBondContact OD2-NH2 3.26Å; D2195-S2252 WeakPolarHBondContact OD2-CB 3.46Å; D2195-S2252 PolarHBondContact OD2-OG 2.9Å
2196	Q	78.7	Confident	87.8	Confident	97 Å²	97	29.5 Å²	29.5	45%	0.453	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-18.3	-177.9	-58	-170.4	-116.7	0	0	113.9	E1980 R1986	E1980-Q2196 WeakPolarHBondContact OE2-CB 3.32Å; R1986-Q2196 PolarHBondContact NH2-O 3.36Å
2197	L	81.5	Confident	87.8	Confident	8 Å²	8	28.2 Å²	28.2	4%	0.042	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-11.3	177.9	-63.8	173.1	0	0	0	115	M1974 E1980 L2087 L2088 W2137 D2195 A2199 M2204	M1974-L2197 HydrophobicContact SD-CD1 4.28Å; E1980-L2197 HydrophobicContact CG-CD2 3.86Å; E1980-L2197 WeakPolarHBondContact OE1-CD2 3.41Å; E1980-L2197 WeakPolarHBondContact OE1-CG 3.46Å; L2087-L2197 HydrophobicContact CB-CD2 4.09Å; L2087-L2197 HydrophobicContact CD1-CD2 3.98Å; L2088-L2197 HydrophobicContact CD2-CB 4.2Å; L2088-L2197 HydrophobicContact CD2-CD1 4.45Å; L2088-L2197 HydrophobicContact CG-CB 4.37Å; W2137-L2197 HydrophobicContact CH2-CD1 4.05Å; D2195-L2197 PolarHBondContact O-N 3.34Å; D2195-L2197 PolarHBondContact OD1-N 2.88Å; D2195-L2197 VanDerWaalsContact OD1-N 3.11Å; L2197-A2199 PolarHBondContact O-N 3.36Å; L2197-M2204 HydrophobicContact CB-CE 4.23Å; L2197-M2204 HydrophobicContact CD1-CE 3.97Å; L2197-M2204 HydrophobicContact CD1-SD 4Å
2198	N	88.4	Confident	88	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.011	12%	0.115	C	C	.	.			trans	-69.6	131.2	-177.1	-65.8	-28.4	0	0	0	111.5	R1986 Y2192 L2193 D2195 W2203 M2204	R1986-N2198 PolarHBondContact NH1-O 2.87Å; R1986-N2198 PolarHBondContact NH2-O 2.9Å; Y2192-N2198 VanDerWaalsContact CZ-ND2 3.34Å; Y2192-N2198 PolarHBondContact OH-ND2 3.32Å; L2193-N2198 PolarHBondContact O-ND2 3.35Å; D2195-N2198 PolarHBondContact N-ND2 3.21Å; D2195-N2198 VanDerWaalsContact N-ND2 3.15Å; D2195-N2198 WeakPolarHBondContact O-CB 3.46Å; D2195-N2198 PolarHBondContact O-N 3.2Å; D2195-N2198 PolarHBondContact O-ND2 3Å; N2198-W2203 HydrophobicContact CB-CB 4.45Å; N2198-W2203 VanDerWaalsContact OD1-CA 3.32Å; N2198-W2203 WeakPolarHBondContact OD1-CA 3.41Å; N2198-M2204 PolarHBondContact OD1-N 3.08Å
2199	A	86.5	Confident	88.1	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.107	C	C	.	.			trans	-116.7	176.4	175.7	0	0	0	0	0	110.6	N2075 T2080 L2082 G2084 L2197 S2201 A2202	N2075-A2199 PolarHBondContact ND2-O 3.28Å; T2080-A2199 VanDerWaalsContact OG1-CA 3.27Å; T2080-A2199 WeakPolarHBondContact OG1-CA 3.44Å; L2082-A2199 HydrophobicContact CB-CB 4.02Å; G2084-A2199 WeakPolarHBondContact O-CB 3.4Å; L2197-A2199 PolarHBondContact O-N 3.36Å; A2199-S2201 PolarHBondContact O-N 3.39Å; A2199-A2202 PolarHBondContact N-O 3.37Å; A2199-A2202 VanDerWaalsContact O-O 3.1Å
2200	D	87.6	Confident	88.4	Confident	5 Å²	5	18.6 Å²	18.6	3%	0.027	9%	0.093	C	C	.	.	S	Bend	trans	-65.8	-28.1	-179.9	-72.1	-2.4	0	0	0	112.2	W1996 Y2003 N2075 T2080 G2081 L2082	W1996-D2200 HydrophobicContact CH2-CB 4.11Å; W1996-D2200 HydrophobicContact CZ2-CB 4.12Å; Y2003-D2200 WeakPolarHBondContact CE1-OD2 3.44Å; Y2003-D2200 PolarHBondContact OH-OD1 3.37Å; Y2003-D2200 VanDerWaalsContact OH-OD1 3.1Å; Y2003-D2200 PolarHBondContact OH-OD2 3.46Å; N2075-D2200 PolarHBondContact N-O 3.05Å; T2080-D2200 WeakPolarHBondContact CA-OD1 3.44Å; T2080-D2200 WeakPolarHBondContact CB-OD1 3.36Å; T2080-D2200 PolarHBondContact N-OD1 3.33Å; T2080-D2200 PolarHBondContact OG1-N 2.79Å; T2080-D2200 PolarHBondContact OG1-OD1 2.84Å; G2081-D2200 PolarHBondContact N-OD1 3.03Å; L2082-D2200 WeakPolarHBondContact O-CB 3.4Å; L2082-D2200 VanDerWaalsContact O-CG 3.29Å; L2082-D2200 PolarHBondContact O-N 2.94Å
2201	S	87.3	Confident	88.3	Confident	12 Å²	12	15.4 Å²	15.4	8%	0.084	8%	0.08	C	C	.	.	S	Bend	trans	-121.6	7.6	-177.8	-54.2	0	0	0	0	115.6	P2073 G2084 G2092 A2199	P2073-S2201 WeakPolarHBondContact CG-O 3.46Å; P2073-S2201 WeakPolarHBondContact O-CA 3.17Å; P2073-S2201 VanDerWaalsContact O-CB 3.27Å; P2073-S2201 WeakPolarHBondContact O-CB 3.14Å; P2073-S2201 PolarHBondContact O-OG 2.9Å; P2073-S2201 VanDerWaalsContact O-OG 3.13Å; G2084-S2201 WeakPolarHBondContact O-CB 3.36Å; G2084-S2201 PolarHBondContact O-N 3.32Å; G2092-S2201 PolarHBondContact N-O 2.8Å; A2199-S2201 PolarHBondContact O-N 3.39Å
2202	A	89	Confident	88.3	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	137.3	169.4	0	0	0	0	0	110.4	K2085 L2088 R2090 G2092 A2199	K2085-A2202 HydrophobicContact CB-CB 4Å; K2085-A2202 HydrophobicContact CG-CB 4.44Å; L2088-A2202 HydrophobicContact CB-CB 4.06Å; L2088-A2202 HydrophobicContact CD1-CB 3.83Å; R2090-A2202 WeakPolarHBondContact O-CB 3.26Å; G2092-A2202 WeakPolarHBondContact O-CA 3.47Å; A2199-A2202 PolarHBondContact N-O 3.37Å; A2199-A2202 VanDerWaalsContact O-O 3.1Å
2203	W	91.4	Very high	88.1	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	163	179.7	60.4	91.8	0	0	0	111.2	Y2064 P2073 N2075 P2076 G2092 P2093 N2094 Y2192 N2198 E2205	Y2064-W2203 AromaticContact CD1-CH2 3.88Å; Y2064-W2203 HydrophobicContact CD1-CH2 3.88Å; Y2064-W2203 AromaticContact CD1-CZ2 3.73Å; Y2064-W2203 HydrophobicContact CD1-CZ2 3.73Å; Y2064-W2203 AromaticContact CD2-CH2 3.95Å; Y2064-W2203 HydrophobicContact CD2-CH2 3.95Å; Y2064-W2203 HydrophobicContact CE1-CH2 4.39Å; Y2064-W2203 HydrophobicContact CE1-CZ2 4.3Å; Y2064-W2203 HydrophobicContact CE2-CH2 4.49Å; Y2064-W2203 AromaticContact CG-CH2 3.63Å; Y2064-W2203 HydrophobicContact CG-CH2 3.63Å; Y2064-W2203 AromaticContact CG-CZ2 3.91Å; Y2064-W2203 HydrophobicContact CG-CZ2 3.91Å; P2073-W2203 HydrophobicContact CB-CH2 4.16Å; P2073-W2203 HydrophobicContact CB-CZ3 4.15Å; N2075-W2203 HydrophobicContact CB-CE3 3.96Å; N2075-W2203 HydrophobicContact CB-CZ3 4.41Å; P2076-W2203 VanDerWaalsContact CD-CE2 3.42Å; P2076-W2203 VanDerWaalsContact CD-CZ2 3.49Å; P2076-W2203 HydrophobicContact CG-CD2 4.44Å; P2076-W2203 HydrophobicContact CG-CZ2 4.1Å; G2092-W2203 PolarHBondContact O-N 2.91Å; P2093-W2203 HydrophobicContact CB-CZ2 4.23Å; P2093-W2203 HydrophobicContact CG-CZ2 4.43Å; N2094-W2203 WeakPolarHBondContact CB-O 3.5Å; N2094-W2203 PolarHBondContact N-O 3.4Å; N2094-W2203 PolarHBondContact ND2-O 3.3Å; Y2192-W2203 HydrophobicContact CD2-CB 4.25Å; Y2192-W2203 AromaticContact CD2-CD1 3.59Å; Y2192-W2203 HydrophobicContact CD2-CG 4.08Å; Y2192-W2203 HydrophobicContact CE2-CB 3.58Å; Y2192-W2203 AromaticContact CE2-CD1 3.79Å; Y2192-W2203 AromaticContact CE2-CG 3.78Å; Y2192-W2203 HydrophobicContact CE2-CG 3.78Å; N2198-W2203 HydrophobicContact CB-CB 4.45Å; N2198-W2203 VanDerWaalsContact OD1-CA 3.32Å; N2198-W2203 WeakPolarHBondContact OD1-CA 3.41Å; W2203-E2205 PolarHBondContact NE1-OE1 3.28Å
2204	M	91.4	Very high	87.4	Confident	2 Å²	2	15.3 Å²	15.3	1%	0.01	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.1	177.2	-66.2	-161	-62	0	0	112.4	L2088 N2094 W2137 L2139 L2193 D2195 L2197 N2198	L2088-M2204 HydrophobicContact CD1-CG 4.16Å; L2088-M2204 HydrophobicContact CD2-CG 3.66Å; L2088-M2204 HydrophobicContact CD2-SD 4.03Å; N2094-M2204 WeakPolarHBondContact O-CA 3.25Å; W2137-M2204 HydrophobicContact CH2-SD 4.49Å; W2137-M2204 HydrophobicContact CZ3-SD 4.05Å; L2139-M2204 HydrophobicContact CD2-SD 4.37Å; L2193-M2204 HydrophobicContact CD2-CE 4.33Å; L2193-M2204 PolarHBondContact N-O 3Å; D2195-M2204 HydrophobicContact CB-CE 3.39Å; D2195-M2204 VanDerWaalsContact OD1-CE 3.23Å; D2195-M2204 WeakPolarHBondContact OD1-CE 3.36Å; L2197-M2204 HydrophobicContact CB-CE 4.23Å; L2197-M2204 HydrophobicContact CD1-CE 3.97Å; L2197-M2204 HydrophobicContact CD1-SD 4Å; N2198-M2204 PolarHBondContact OD1-N 3.08Å
2205	E	91.4	Very high	86.6	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.005	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.8	169.2	-62.1	-176.4	-176.8	0	0	108.5	S2059 L2060 P2093 N2094 H2095 S2096 G2191 W2203	S2059-E2205 WeakPolarHBondContact CA-OE2 3.42Å; S2059-E2205 WeakPolarHBondContact CB-OE1 3.42Å; S2059-E2205 PolarHBondContact OG-OE1 2.81Å; S2059-E2205 PolarHBondContact OG-OE2 3.36Å; L2060-E2205 WeakPolarHBondContact CB-OE2 3.35Å; L2060-E2205 HydrophobicContact CD1-CB 4.29Å; L2060-E2205 WeakPolarHBondContact CG-OE2 3.23Å; L2060-E2205 PolarHBondContact N-OE2 3.17Å; P2093-E2205 HydrophobicContact CB-CG 4.35Å; N2094-E2205 PolarHBondContact O-N 3.38Å; H2095-E2205 CarbonylContact C-O 3.58Å; H2095-E2205 WeakPolarHBondContact CA-O 3.46Å; H2095-E2205 IonicContact NE2-OE2 2.77Å; S2096-E2205 PolarHBondContact N-O 2.9Å; S2096-E2205 PolarHBondContact OG-O 3.42Å; S2096-E2205 VanDerWaalsContact OG-O 3.05Å; G2191-E2205 CarbonylContact O-C 3.55Å; G2191-E2205 VanDerWaalsContact O-CA 3.3Å; G2191-E2205 WeakPolarHBondContact O-CA 3.34Å; W2203-E2205 PolarHBondContact NE1-OE1 3.28Å
2206	T	89.7	Confident	85.7	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	150	-169.3	-153.1	0	0	0	0	113.5	S2096 F2189 K2190 G2191 L2193 V2208	S2096-T2206 CarbonylContact O-C 3.5Å; S2096-T2206 VanDerWaalsContact O-CA 3.28Å; S2096-T2206 WeakPolarHBondContact O-CA 3.48Å; S2096-T2206 PolarHBondContact O-OG1 3.17Å; S2096-T2206 WeakPolarHBondContact OG-CA 3.48Å; S2096-T2206 WeakPolarHBondContact OG-CB 3.24Å; S2096-T2206 PolarHBondContact OG-OG1 2.82Å; F2189-T2206 HydrophobicContact CD1-CG2 4Å; F2189-T2206 HydrophobicContact CE1-CG2 4.14Å; K2190-T2206 WeakPolarHBondContact CA-O 3.42Å; G2191-T2206 PolarHBondContact N-O 3.35Å; G2191-T2206 VanDerWaalsContact N-O 3.15Å; G2191-T2206 PolarHBondContact O-N 2.85Å; L2193-T2206 HydrophobicContact CB-CG2 3.9Å; L2193-T2206 HydrophobicContact CD1-CG2 4.04Å; L2193-T2206 HydrophobicContact CD2-CG2 4.05Å; L2193-T2206 HydrophobicContact CG-CG2 4.22Å; T2206-V2208 HydrophobicContact CG2-CG2 3.77Å
2207	V	89.8	Confident	84.8	Confident	6 Å²	6	26.5 Å²	26.5	4%	0.036	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.4	166.1	-178.1	0	0	0	0	108.7	S2096 F2097 V2098 V2152 Q2187 K2190 I2209	S2096-V2207 PolarHBondContact O-N 2.94Å; F2097-V2207 CarbonylContact C-O 3.3Å; F2097-V2207 WeakPolarHBondContact CA-O 3.46Å; F2097-V2207 VanDerWaalsContact CB-O 3.29Å; F2097-V2207 WeakPolarHBondContact CB-O 3.25Å; V2098-V2207 PolarHBondContact N-O 2.71Å; V2152-V2207 HydrophobicContact CG1-CB 4.5Å; V2152-V2207 HydrophobicContact CG1-CG1 4.42Å; V2152-V2207 HydrophobicContact CG2-CB 4.47Å; V2152-V2207 HydrophobicContact CG2-CG2 4.39Å; Q2187-V2207 HydrophobicContact CG-CG1 4.46Å; K2190-V2207 HydrophobicContact CG-CG2 4.31Å; V2207-I2209 HydrophobicContact CG1-CD1 4.45Å; V2207-I2209 HydrophobicContact CG1-CG1 4.39Å
2208	V	90.6	Very high	83.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.2	-177.2	-171.7	0	0	0	0	110.4	V2098 Q2187 I2188 F2189 T2206 I2256	V2098-V2208 HydrophobicContact CB-CG1 4.26Å; V2098-V2208 HydrophobicContact CB-CG2 4.25Å; V2098-V2208 HydrophobicContact CG1-CG1 4.49Å; Q2187-V2208 WeakPolarHBondContact CA-O 3.4Å; I2188-V2208 HydrophobicContact CB-CB 4.31Å; I2188-V2208 HydrophobicContact CB-CG1 4.18Å; I2188-V2208 HydrophobicContact CD1-CG1 3.71Å; I2188-V2208 PolarHBondContact N-O 2.86Å; F2189-V2208 HydrophobicContact CB-CB 4.2Å; F2189-V2208 HydrophobicContact CB-CG2 3.89Å; F2189-V2208 HydrophobicContact CD1-CG2 4.04Å; F2189-V2208 HydrophobicContact CG-CG2 4.47Å; F2189-V2208 PolarHBondContact O-N 3.32Å; T2206-V2208 HydrophobicContact CG2-CG2 3.77Å; V2208-I2256 HydrophobicContact CG1-CD1 4.39Å; V2208-I2256 HydrophobicContact CG1-CG2 3.61Å; V2208-I2256 HydrophobicContact CG2-CD1 3.81Å; V2208-I2256 HydrophobicContact CG2-CG1 4.38Å
2209	I	89.9	Confident	82.6	Confident	6 Å²	6	27.5 Å²	27.5	3%	0.031	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.9	179.6	-68.1	164.7	0	0	0	110.1	V2098 C2100 V2152 L2153 I2156 V2185 V2207 L2211	V2098-I2209 PolarHBondContact O-N 3.31Å; C2100-I2209 PolarHBondContact N-O 3.48Å; V2152-I2209 HydrophobicContact CG1-CD1 3.69Å; L2153-I2209 HydrophobicContact CD2-CD1 3.88Å; L2153-I2209 HydrophobicContact CG-CD1 4.43Å; I2156-I2209 HydrophobicContact CD1-CB 4.39Å; I2156-I2209 HydrophobicContact CD1-CD1 3.39Å; I2156-I2209 HydrophobicContact CD1-CG1 4.44Å; V2185-I2209 HydrophobicContact CG1-CG2 3.71Å; V2207-I2209 HydrophobicContact CG1-CD1 4.45Å; V2207-I2209 HydrophobicContact CG1-CG1 4.39Å; I2209-L2211 HydrophobicContact CG2-CD2 4.5Å
2210	N	91.9	Very high	82	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.7	172.9	-168.2	8.1	0	0	0	110.7	C2100 T2102 V2185 T2186 I2188	C2100-N2210 CarbonylContact O-C 3.39Å; C2100-N2210 WeakPolarHBondContact O-CA 3.35Å; C2100-N2210 PolarHBondContact O-OD1 3.49Å; T2102-N2210 PolarHBondContact OG1-OD1 2.92Å; V2185-N2210 WeakPolarHBondContact CA-O 3.37Å; T2186-N2210 PolarHBondContact N-O 3.39Å; T2186-N2210 WeakPolarHBondContact O-CB 3.5Å; T2186-N2210 PolarHBondContact O-N 2.95Å; T2186-N2210 WeakPolarHBondContact OG1-CB 3.36Å; I2188-N2210 HydrophobicContact CD1-CB 3.76Å; I2188-N2210 HydrophobicContact CG1-CB 4.09Å
2211	L	88.6	Confident	81.6	Confident	10 Å²	10	32.4 Å²	32.4	5%	0.052	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	106.9	167.3	-62.3	179.8	0	0	0	108.6	L2099 C2100 I2101 T2102 I2160 V2185 I2209	L2099-L2211 HydrophobicContact CD1-CD1 3.76Å; L2099-L2211 HydrophobicContact CD1-CG 4.03Å; C2100-L2211 PolarHBondContact O-N 3.37Å; I2101-L2211 WeakPolarHBondContact CA-O 3.3Å; I2101-L2211 HydrophobicContact CG1-CB 4.37Å; I2101-L2211 HydrophobicContact CG1-CD1 4.38Å; T2102-L2211 PolarHBondContact N-O 2.84Å; I2160-L2211 HydrophobicContact CD1-CD1 4.31Å; V2185-L2211 HydrophobicContact CB-CD2 4.2Å; V2185-L2211 HydrophobicContact CG1-CD2 3.92Å; V2185-L2211 HydrophobicContact CG2-CD2 3.55Å; I2209-L2211 HydrophobicContact CG2-CD2 4.5Å
2212	H	89	Confident	81.1	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.023	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	142.1	-174.2	-174.5	67.8	0	0	0	114	T2102 W2104 E2184 S2214 R2264	T2102-H2212 WeakPolarHBondContact O-CA 3.44Å; T2102-H2212 PolarHBondContact O-ND1 3.4Å; T2102-H2212 PolarHBondContact OG1-ND1 3.4Å; W2104-H2212 AromaticContact CE2-NE2 3.88Å; W2104-H2212 AromaticContact NE1-CE1 3.74Å; W2104-H2212 AromaticContact NE1-NE2 3.33Å; W2104-H2212 PolarHBondContact NE1-NE2 3Å; E2184-H2212 HydrophobicContact CB-CB 4.4Å; E2184-H2212 PolarHBondContact N-O 3.25Å; E2184-H2212 PolarHBondContact O-N 3.32Å; H2212-S2214 PolarHBondContact O-N 2.73Å; H2212-R2264 PolarHBondContact CD2-NH1 3.39Å
2213	E	86.1	Confident	80.8	Confident	7 Å²	7	37.5 Å²	37.5	3%	0.033	20%	0.196	C	C	.	.			trans	-64.4	92.4	172	-179.8	171.1	116.7	0	0	111.9	T2102 R2103 R2106 Q2220 L2221	T2102-E2213 PolarHBondContact O-N 3.06Å; R2103-E2213 HydrophobicContact CB-CB 3.86Å; R2106-E2213 IonicContact CZ-OE1 3.42Å; R2106-E2213 VanDerWaalsContact CZ-OE1 3.31Å; R2106-E2213 IonicContact NE-OE1 3.98Å; R2106-E2213 PolarHBondContact NE-OE1 3.25Å; R2106-E2213 IonicContact NH2-OE1 3.59Å; R2106-E2213 PolarHBondContact NH2-OE1 2.91Å; E2213-Q2220 WeakPolarHBondContact OE2-CA 3.39Å; E2213-L2221 PolarHBondContact OE2-N 3.27Å
2214	S	76.3	Confident	80.3	Confident	31 Å²	31	39.3 Å²	39.3	22%	0.217	21%	0.205	C	C	.	.			trans	-53.8	148.3	173.2	169.6	0	0	0	0	112.7	K2182 H2212 S2216	K2182-S2214 WeakPolarHBondContact O-CB 3.24Å; H2212-S2214 PolarHBondContact O-N 2.73Å; S2214-S2216 PolarHBondContact O-N 3.13Å; S2214-S2216 VanDerWaalsContact O-N 3.12Å; S2214-S2216 PolarHBondContact OG-N 3.24Å; S2214-S2216 PolarHBondContact OG-OG 3.45Å
2215	E	70.1	Confident	80	Confident	188 Å²	188	39.4 Å²	39.4	88%	0.879	21%	0.206	S	C	*	.	S	Bend	trans	-64.2	-15.1	178.4	-62	-173.3	169.1	0	0	113.8
2216	S	65.3	Low	79.6	Confident	57 Å²	57	40.7 Å²	40.7	40%	0.399	21%	0.213	S	C	.	.	S	Bend	trans	-67	133.7	-178.4	66.8	0	0	0	0	112.6	S2214 G2218 A2219	S2214-S2216 PolarHBondContact O-N 3.13Å; S2214-S2216 VanDerWaalsContact O-N 3.12Å; S2214-S2216 PolarHBondContact OG-N 3.24Å; S2214-S2216 PolarHBondContact OG-OG 3.45Å; S2216-G2218 PolarHBondContact O-N 3.37Å; S2216-A2219 PolarHBondContact O-N 2.91Å; S2216-A2219 VanDerWaalsContact O-N 3.11Å
2217	K	60.1	Low	79.2	Confident	217 Å²	217	46.3 Å²	46.3	94%	0.943	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	96.1	173.9	-80.2	-175.9	178.7	177	0	109.7
2218	G	59.8	Low	78.8	Confident	30 Å²	30	46.4 Å²	46.4	31%	0.309	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	139.7	-10.6	-177.6	0	0	0	0	0	115	R2179 S2216	R2179-G2218 WeakPolarHBondContact CG-O 3.48Å; S2216-G2218 PolarHBondContact O-N 3.37Å
2219	A	63.2	Low	78.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.			trans	-93.5	8.8	178.3	0	0	0	0	0	114.5	K2182 S2216 L2221	K2182-A2219 HydrophobicContact CB-CB 4.04Å; K2182-A2219 WeakPolarHBondContact O-CB 3.08Å; S2216-A2219 PolarHBondContact O-N 2.91Å; S2216-A2219 VanDerWaalsContact O-N 3.11Å; A2219-L2221 PolarHBondContact O-N 3.24Å
2220	Q	73.7	Confident	78	Confident	102 Å²	102	49 Å²	49	48%	0.477	25%	0.252	S	S	.	.			trans	-67.4	114.1	-177.8	-70.8	179.4	-8.3	0	0	111.9	R2179 E2213 P2222	R2179-Q2220 WeakPolarHBondContact CD-O 3.35Å; R2179-Q2220 PolarHBondContact NH1-O 3.37Å; E2213-Q2220 WeakPolarHBondContact OE2-CA 3.39Å; Q2220-P2222 VanDerWaalsContact O-CD 3.3Å; Q2220-P2222 WeakPolarHBondContact O-CD 3.48Å
2221	L	79.4	Confident	77.3	Confident	7 Å²	7	50 Å²	50	4%	0.037	26%	0.256	C	S	.	.			trans	-73.3	112.6	-177.3	-70.7	170.5	0	0	0	110	I2101 I2180 E2213 A2219 I2225	I2101-L2221 HydrophobicContact CG2-CD1 3.73Å; I2180-L2221 HydrophobicContact CG1-CD2 4.38Å; E2213-L2221 PolarHBondContact OE2-N 3.27Å; A2219-L2221 PolarHBondContact O-N 3.24Å; L2221-I2225 HydrophobicContact CD2-CD1 4.23Å
2222	P	77.5	Confident	76.3	Confident	26 Å²	26	52.5 Å²	52.5	17%	0.169	27%	0.273	C	S	.	.			trans	-76.1	158.3	-179.9	30.7	-29.4	0	0	0	111.2	L2176 Q2220 D2224 I2225	L2176-P2222 HydrophobicContact CD1-CG 3.91Å; Q2220-P2222 VanDerWaalsContact O-CD 3.3Å; Q2220-P2222 WeakPolarHBondContact O-CD 3.48Å; P2222-D2224 HydrophobicContact CB-CB 4.48Å; P2222-D2224 HydrophobicContact CG-CB 4.31Å; P2222-D2224 PolarHBondContact O-N 3.15Å; P2222-I2225 WeakPolarHBondContact O-CG2 3.26Å; P2222-I2225 PolarHBondContact O-N 2.96Å; P2222-I2225 VanDerWaalsContact O-N 3.15Å
2223	D	82.4	Confident	75.3	Confident	92 Å²	92	59.2 Å²	59.2	49%	0.492	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-7.8	175	-64.1	-20.8	0	0	0	113.5	R2103 I2225 L2226 W2240	R2103-D2223 IonicContact CZ-OD1 2.8Å; R2103-D2223 IonicContact NH1-OD1 3.77Å; R2103-D2223 PolarHBondContact NH1-OD1 3.33Å; R2103-D2223 IonicContact NH2-OD1 3.01Å; D2223-I2225 PolarHBondContact O-N 2.97Å; D2223-L2226 HydrophobicContact CB-CD1 4.17Å; D2223-L2226 WeakPolarHBondContact O-CB 3.36Å; D2223-L2226 PolarHBondContact O-N 3.06Å; D2223-W2240 PolarHBondContact OD1-NE1 3.06Å; D2223-W2240 VanDerWaalsContact OD1-NE1 3.08Å
2224	D	80.9	Confident	74.5	Confident	38 Å²	38	60.5 Å²	60.5	20%	0.203	32%	0.317	C	S	.	.	H	α-helix	trans	-60.3	-25.8	171.1	-72.7	-34.3	0	0	0	112.4	L2168 R2172 P2222 L2226 K2227	L2168-D2224 HydrophobicContact CD1-CB 4.5Å; L2168-D2224 HydrophobicContact CD2-CB 4.33Å; R2172-D2224 IonicContact NH1-OD1 3.95Å; R2172-D2224 PolarHBondContact NH1-OD1 3.39Å; P2222-D2224 HydrophobicContact CB-CB 4.48Å; P2222-D2224 HydrophobicContact CG-CB 4.31Å; P2222-D2224 PolarHBondContact O-N 3.15Å; D2224-L2226 VanDerWaalsContact C-N 3.29Å; D2224-L2226 PolarHBondContact O-N 3.3Å; D2224-K2227 PolarHBondContact O-N 3.12Å
2225	I	83.8	Confident	74.3	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-28.9	177.7	-160.3	162.6	0	0	0	113	I2101 L2125 I2180 L2221 P2222 D2223 K2227 L2228 W2240	I2101-I2225 HydrophobicContact CD1-CD1 3.84Å; I2101-I2225 HydrophobicContact CD1-CG1 4.25Å; I2101-I2225 HydrophobicContact CG2-CD1 4.21Å; L2125-I2225 HydrophobicContact CD1-CG2 4.09Å; I2180-I2225 HydrophobicContact CD1-CD1 4.47Å; L2221-I2225 HydrophobicContact CD2-CD1 4.23Å; P2222-I2225 WeakPolarHBondContact O-CG2 3.26Å; P2222-I2225 PolarHBondContact O-N 2.96Å; P2222-I2225 VanDerWaalsContact O-N 3.15Å; D2223-I2225 PolarHBondContact O-N 2.97Å; I2225-K2227 PolarHBondContact O-N 2.78Å; I2225-L2228 WeakPolarHBondContact O-CB 3.36Å; I2225-L2228 PolarHBondContact O-N 3.18Å; I2225-L2228 VanDerWaalsContact O-N 3.14Å; I2225-W2240 HydrophobicContact CG2-CH2 4.41Å; I2225-W2240 HydrophobicContact CG2-CZ2 3.8Å
2226	L	84.4	Confident	74.7	Confident	28 Å²	28	56.2 Å²	56.2	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-35.1	178.9	-67.7	169.4	0	0	0	111.4	L2125 D2223 D2224 L2228 S2238	L2125-L2226 HydrophobicContact CD1-CD2 3.63Å; L2125-L2226 HydrophobicContact CD1-CG 4.48Å; L2125-L2226 HydrophobicContact CG-CD2 3.91Å; D2223-L2226 HydrophobicContact CB-CD1 4.17Å; D2223-L2226 WeakPolarHBondContact O-CB 3.36Å; D2223-L2226 PolarHBondContact O-N 3.06Å; D2224-L2226 VanDerWaalsContact C-N 3.29Å; D2224-L2226 PolarHBondContact O-N 3.3Å; L2226-L2228 VanDerWaalsContact C-N 3.32Å; L2226-L2228 PolarHBondContact O-N 3.42Å; L2226-S2238 WeakPolarHBondContact CB-OG 3.32Å; L2226-S2238 PolarHBondContact O-OG 3.13Å
2227	K	81.4	Confident	75.4	Confident	118 Å²	118	59.8 Å²	59.8	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-71.9	-25.9	-178.9	-65.7	179.8	-179.8	174.7	0	113	D2224 I2225 L2229	D2224-K2227 PolarHBondContact O-N 3.12Å; I2225-K2227 PolarHBondContact O-N 2.78Å; K2227-L2229 VanDerWaalsContact C-N 3.27Å; K2227-L2229 PolarHBondContact O-N 3.06Å
2228	L	81.5	Confident	76.7	Confident	7 Å²	7	50.3 Å²	50.3	4%	0.037	27%	0.265	C	S	.	.	H	α-helix	trans	-71.6	-19.3	-179.1	-65.1	-178.6	0	0	0	113.2	I2160 R2163 M2167 L2168 L2176 I2225 L2226	I2160-L2228 HydrophobicContact CG2-CD1 4.33Å; R2163-L2228 HydrophobicContact CB-CD2 4.12Å; R2163-L2228 WeakPolarHBondContact CD-O 3.32Å; R2163-L2228 PolarHBondContact NH1-O 3.28Å; M2167-L2228 HydrophobicContact CB-CD2 4.38Å; L2168-L2228 HydrophobicContact CD1-CD2 3.9Å; L2168-L2228 HydrophobicContact CD1-CG 4.32Å; L2168-L2228 HydrophobicContact CG-CD2 4.5Å; L2176-L2228 HydrophobicContact CD2-CD1 3.46Å; L2176-L2228 VanDerWaalsContact CD2-CD1 3.46Å; L2176-L2228 HydrophobicContact CD2-CG 4.3Å; I2225-L2228 WeakPolarHBondContact O-CB 3.36Å; I2225-L2228 PolarHBondContact O-N 3.18Å; I2225-L2228 VanDerWaalsContact O-N 3.14Å; L2226-L2228 VanDerWaalsContact C-N 3.32Å; L2226-L2228 PolarHBondContact O-N 3.42Å
2229	L	81.8	Confident	77.9	Confident	11 Å²	11	54.2 Å²	54.2	6%	0.058	27%	0.274	C	S	.	.	H	α-helix	trans	-106.1	-8	-173.1	-65.6	167.3	0	0	0	114.1	R1973 L2099 I2101 L2125 P2136 K2227	R1973-L2229 PolarHBondContact NH1-O 3.25Å; L2099-L2229 HydrophobicContact CD2-CD2 4.31Å; I2101-L2229 HydrophobicContact CD1-CD1 3.75Å; L2125-L2229 HydrophobicContact CD1-CD1 3.84Å; L2125-L2229 HydrophobicContact CD2-CD1 3.52Å; L2125-L2229 HydrophobicContact CG-CD1 4.36Å; P2136-L2229 HydrophobicContact CB-CD1 4.49Å; P2136-L2229 HydrophobicContact CB-CD2 4.27Å; P2136-L2229 HydrophobicContact CG-CD1 3.83Å; P2136-L2229 HydrophobicContact CG-CD2 4.48Å; K2227-L2229 VanDerWaalsContact C-N 3.27Å; K2227-L2229 PolarHBondContact O-N 3.06Å
2230	N	81	Confident	79	Confident	51 Å²	51	55.7 Å²	55.7	27%	0.273	28%	0.279	S	S	.	.			trans	-78.3	159.6	176.5	-70.6	-16.6	0	0	0	112.3	R2163 S2238	R2163-N2230 PolarHBondContact NH1-O 3.38Å; R2163-N2230 PolarHBondContact NH2-O 3.21Å; N2230-S2238 PolarHBondContact ND2-OG 3.02Å; N2230-S2238 VanDerWaalsContact ND2-OG 3.14Å; N2230-S2238 WeakPolarHBondContact OD1-CB 3.34Å; N2230-S2238 PolarHBondContact OD1-N 3.12Å; N2230-S2238 VanDerWaalsContact OD1-N 3.09Å; N2230-S2238 PolarHBondContact OD1-OG 3.35Å
2231	E	76.8	Confident	79.7	Confident	19 Å²	19	52.3 Å²	52.3	9%	0.089	26%	0.264	C	S	.	.			trans	-125	157.7	-168	-65.2	-65.4	-174.8	0	0	114.3	R1964 R1973 R2163 T2234	R1964-E2231 IonicContact CZ-OE1 3.09Å; R1964-E2231 IonicContact CZ-OE2 2.66Å; R1964-E2231 IonicContact NH1-OE1 2.81Å; R1964-E2231 PolarHBondContact NH1-OE1 2.9Å; R1964-E2231 IonicContact NH1-OE2 3.72Å; R1964-E2231 IonicContact NH2-OE1 3.02Å; R1964-E2231 PolarHBondContact NH2-OE1 2.97Å; R1964-E2231 IonicContact NH2-OE2 3.95Å; R1964-E2231 PolarHBondContact NH2-OE2 3.47Å; R1973-E2231 WeakPolarHBondContact CD-OE1 3.47Å; R1973-E2231 IonicContact CZ-OE1 2.73Å; R1973-E2231 IonicContact NE-OE1 2.74Å; R1973-E2231 IonicContact NH1-OE1 3.18Å; R1973-E2231 PolarHBondContact NH1-OE1 3.26Å; R2163-E2231 IonicContact CZ-OE2 2.7Å; R2163-E2231 IonicContact NH1-OE1 3.33Å; R2163-E2231 IonicContact NH1-OE2 2.99Å; R2163-E2231 IonicContact NH2-OE1 3.9Å; R2163-E2231 IonicContact NH2-OE2 2.77Å; R2163-E2231 PolarHBondContact NH2-OE2 2.98Å; E2231-T2234 HydrophobicContact CB-CG2 4.15Å; E2231-T2234 PolarHBondContact O-OG1 2.8Å
2232	P	68.4	Low	80	Confident	63 Å²	63	55.2 Å²	55.2	41%	0.409	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	134.1	178.9	29.1	-34.4	0	0	0	112	R1960 T2234	R1960-P2232 PolarHBondContact NH2-O 3.27Å; P2232-T2234 VanDerWaalsContact C-N 3.35Å; P2232-T2234 PolarHBondContact O-N 3.09Å
2233	N	67.7	Low	80.2	Confident	147 Å²	147	54 Å²	54	79%	0.786	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	43.3	175.1	-59.4	-1.7	0	0	0	113.9	R1960	R1960-N2233 PolarHBondContact NH2-O 3.45Å
2234	T	69.3	Low	79.7	Confident	33 Å²	33	51.6 Å²	51.6	20%	0.202	26%	0.26	C	S	.	.			trans	-126.2	147.1	174.9	57.8	0	0	0	0	111.5	A1975 E2231 P2232 E2236	A1975-T2234 HydrophobicContact CB-CG2 4.06Å; E2231-T2234 HydrophobicContact CB-CG2 4.15Å; E2231-T2234 PolarHBondContact O-OG1 2.8Å; P2232-T2234 VanDerWaalsContact C-N 3.35Å; P2232-T2234 PolarHBondContact O-N 3.09Å; T2234-E2236 PolarHBondContact O-N 3.29Å
2235	E	72.8	Confident	79	Confident	120 Å²	120	56.5 Å²	56.5	56%	0.561	28%	0.281	S	S	*	.			trans	-76.8	6.3	173.8	-64	178.8	160	0	0	113.6	R2129	R2129-E2235 IonicContact CZ-OE2 3.1Å; R2129-E2235 IonicContact NH1-OE2 3.57Å; R2129-E2235 PolarHBondContact NH1-OE2 2.79Å
2236	E	77.5	Confident	77.9	Confident	9 Å²	9	59 Å²	59	4%	0.042	30%	0.299	C	S	.	.			trans	-75.4	132	-178.7	-59.7	178.3	178.2	0	0	111.5	R1973 P1976 F1977 R2129 T2234	R1973-E2236 IonicContact CZ-OE2 2.65Å; R1973-E2236 IonicContact NE-OE2 2.94Å; R1973-E2236 IonicContact NH2-OE2 2.94Å; R1973-E2236 PolarHBondContact NH2-OE2 3.23Å; P1976-E2236 WeakPolarHBondContact CA-OE1 3.41Å; F1977-E2236 VanDerWaalsContact CD1-CD 3.46Å; F1977-E2236 HydrophobicContact CD1-CG 3.85Å; F1977-E2236 WeakPolarHBondContact CD1-OE1 3.47Å; F1977-E2236 HydrophobicContact CE1-CG 4.08Å; F1977-E2236 PolarHBondContact N-OE1 2.77Å; R2129-E2236 HydrophobicContact CB-CG 4.45Å; T2234-E2236 PolarHBondContact O-N 3.29Å
2237	Q	80.9	Confident	76.8	Confident	132 Å²	132	58.6 Å²	58.6	62%	0.617	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.2	176.8	-60.6	-173.6	13.4	0	0	111.3	L2127 E2128	L2127-Q2237 CarbonylContact C-O 2.91Å; E2128-Q2237 PolarHBondContact N-O 3.44Å; E2128-Q2237 PolarHBondContact O-N 2.81Å
2238	S	85.8	Confident	76.3	Confident	18 Å²	18	58.1 Å²	58.1	13%	0.126	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	133.2	171.8	57.8	0	0	0	0	111.9	A2126 L2226 N2230	A2126-S2238 WeakPolarHBondContact O-CA 3.42Å; L2226-S2238 WeakPolarHBondContact CB-OG 3.32Å; L2226-S2238 PolarHBondContact O-OG 3.13Å; N2230-S2238 PolarHBondContact ND2-OG 3.02Å; N2230-S2238 VanDerWaalsContact ND2-OG 3.14Å; N2230-S2238 WeakPolarHBondContact OD1-CB 3.34Å; N2230-S2238 PolarHBondContact OD1-N 3.12Å; N2230-S2238 VanDerWaalsContact OD1-N 3.09Å; N2230-S2238 PolarHBondContact OD1-OG 3.35Å
2239	K	85.9	Confident	76.1	Confident	113 Å²	113	58.4 Å²	58.4	49%	0.491	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.8	-179	-169	177.5	176	-176	0	111.7	A2126	A2126-K2239 PolarHBondContact N-O 3.32Å; A2126-K2239 PolarHBondContact O-N 3.06Å
2240	W	86.8	Confident	76	Confident	30 Å²	30	59.1 Å²	59.1	11%	0.114	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128.3	167.8	-67.3	108.3	0	0	0	110.4	I2101 R2103 Q2123 Y2124 L2125 D2223 I2225	I2101-W2240 HydrophobicContact CG2-CH2 3.78Å; I2101-W2240 HydrophobicContact CG2-CZ3 4.22Å; R2103-W2240 HydrophobicContact CB-CZ3 4.46Å; R2103-W2240 HydrophobicContact CG-CE3 4.1Å; R2103-W2240 HydrophobicContact CG-CH2 4.16Å; R2103-W2240 HydrophobicContact CG-CZ3 3.84Å; R2103-W2240 VanDerWaalsContact CZ-CE2 3.48Å; Q2123-W2240 HydrophobicContact CB-CE3 4.4Å; Y2124-W2240 WeakPolarHBondContact O-CA 3.29Å; L2125-W2240 HydrophobicContact CB-CE3 4.24Å; L2125-W2240 HydrophobicContact CB-CZ3 4.09Å; D2223-W2240 PolarHBondContact OD1-NE1 3.06Å; D2223-W2240 VanDerWaalsContact OD1-NE1 3.08Å; I2225-W2240 HydrophobicContact CG2-CH2 4.41Å; I2225-W2240 HydrophobicContact CG2-CZ2 3.8Å
2241	I	86.9	Confident	75.9	Confident	32 Å²	32	61.2 Å²	61.2	16%	0.164	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.5	-176.2	-56.6	-173.6	0	0	0	109.7	Q2123 Y2124 A2126 L2133	Q2123-I2241 CarbonylContact C-O 2.93Å; Q2123-I2241 VanDerWaalsContact CA-O 3.23Å; Q2123-I2241 WeakPolarHBondContact CA-O 3.45Å; Y2124-I2241 HydrophobicContact CD1-CB 4.31Å; Y2124-I2241 VanDerWaalsContact CD1-O 3.3Å; Y2124-I2241 WeakPolarHBondContact CD1-O 3.25Å; Y2124-I2241 HydrophobicContact CE1-CB 3.79Å; Y2124-I2241 HydrophobicContact CE1-CG2 3.79Å; Y2124-I2241 PolarHBondContact N-O 3.11Å; Y2124-I2241 PolarHBondContact O-N 2.82Å; A2126-I2241 HydrophobicContact CB-CD1 3.6Å; A2126-I2241 HydrophobicContact CB-CG1 4.23Å; L2133-I2241 HydrophobicContact CD1-CD1 3.53Å; L2133-I2241 HydrophobicContact CD2-CD1 3.31Å; L2133-I2241 HydrophobicContact CG-CD1 4Å
2242	E	86	Confident	76.2	Confident	68 Å²	68	60.7 Å²	60.7	32%	0.318	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	147.5	174.3	-71.2	-172.9	-176.9	0	0	111.3	R2116 V2121 Q2123	R2116-E2242 IonicContact CZ-OE2 3.42Å; R2116-E2242 IonicContact NH1-OE2 3.58Å; R2116-E2242 IonicContact NH2-OE2 3.85Å; R2116-E2242 PolarHBondContact NH2-OE2 2.87Å; V2121-E2242 HydrophobicContact CG1-CG 4.35Å; Q2123-E2242 HydrophobicContact CG-CG 4.38Å
2243	V	82.5	Confident	77.1	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.006	30%	0.3	C	S	.	.			trans	-81.5	120.3	177.7	172.5	0	0	0	0	110.6	L2122 Y2124 L2257 A2261 Y2268	L2122-V2243 HydrophobicContact CB-CB 4.27Å; L2122-V2243 HydrophobicContact CB-CG2 3.91Å; L2122-V2243 HydrophobicContact CD2-CG2 4.25Å; L2122-V2243 HydrophobicContact CG-CG2 4.3Å; L2122-V2243 WeakPolarHBondContact O-CG2 3.49Å; L2122-V2243 PolarHBondContact O-N 2.94Å; Y2124-V2243 HydrophobicContact CD1-CG2 3.82Å; Y2124-V2243 HydrophobicContact CE1-CG2 4.47Å; V2243-L2257 HydrophobicContact CG2-CD1 4.07Å; V2243-L2257 HydrophobicContact CG2-CD2 4.37Å; V2243-L2257 HydrophobicContact CG2-CG 4.42Å; V2243-A2261 HydrophobicContact CG1-CB 3.98Å; V2243-Y2268 HydrophobicContact CG1-CD2 3.52Å; V2243-Y2268 HydrophobicContact CG1-CE2 4.17Å
2244	S	71.8	Confident	77.9	Confident	40 Å²	40	52.7 Å²	52.7	28%	0.28	27%	0.273	S	S	.	.			trans	-168.8	153	172.4	54.6	0	0	0	0	111.9	S2246 Y2268	S2244-S2246 VanDerWaalsContact C-N 3.3Å; S2244-S2246 PolarHBondContact O-N 3.1Å; S2244-Y2268 WeakPolarHBondContact CA-OXT 3.39Å
2245	H	65.6	Low	78.6	Confident	141 Å²	141	58.2 Å²	58.2	65%	0.653	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-27.5	-168.9	-157.9	-79.8	0	0	0	118.4	Y2268	H2245-Y2268 HydrophobicContact CB-CE1 4.35Å; H2245-Y2268 AromaticContact CD2-CE1 3.68Å; H2245-Y2268 PolarHBondContact N-OXT 3.49Å
2246	S	61	Low	79.3	Confident	57 Å²	57	52.7 Å²	52.7	40%	0.399	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	24.1	-169.4	58.9	0	0	0	0	115.7	S2244	S2244-S2246 VanDerWaalsContact C-N 3.3Å; S2244-S2246 PolarHBondContact O-N 3.1Å
2247	S	62.5	Low	79.9	Confident	20 Å²	20	52.3 Å²	52.3	14%	0.14	26%	0.263	C	S	.	.			trans	-75.2	133.5	174.5	62	0	0	0	0	111.7	L2249	S2247-L2249 PolarHBondContact O-N 3.49Å
2248	N	69.8	Low	80.1	Confident	108 Å²	108	50.5 Å²	50.5	58%	0.578	25%	0.253	S	S	*	.			trans	-66.9	45.3	170.6	-74	-21.9	0	0	0	113	K2131 L2133	K2131-N2248 VanDerWaalsContact O-CB 3.26Å; K2131-N2248 WeakPolarHBondContact O-CB 3.29Å; K2131-N2248 PolarHBondContact O-ND2 3.1Å; L2133-N2248 PolarHBondContact N-O 3.36Å
2249	L	78.2	Confident	80.1	Confident	13 Å²	13	51.7 Å²	51.7	7%	0.068	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-80	142.1	178.3	-170.3	65.8	0	0	0	109.5	Y2124 L2133 S2247 T2251 H2253 N2254 L2257	Y2124-L2249 HydrophobicContact CE2-CD1 4.1Å; Y2124-L2249 HydrophobicContact CE2-CD2 4.42Å; L2133-L2249 HydrophobicContact CB-CD1 3.96Å; L2133-L2249 CarbonylContact O-C 3.36Å; L2133-L2249 WeakPolarHBondContact O-CA 3.27Å; S2247-L2249 PolarHBondContact O-N 3.49Å; L2249-T2251 PolarHBondContact O-N 3.46Å; L2249-H2253 HydrophobicContact CD1-CB 4.17Å; L2249-H2253 HydrophobicContact CD2-CB 3.99Å; L2249-H2253 HydrophobicContact CG-CB 3.8Å; L2249-N2254 HydrophobicContact CD2-CB 4.47Å; L2249-L2257 HydrophobicContact CD2-CB 4.16Å; L2249-L2257 HydrophobicContact CD2-CD2 3.89Å
2250	R	79.8	Confident	80.2	Confident	26 Å²	26	46.3 Å²	46.3	10%	0.098	24%	0.235	C	C	.	.			trans	-44.2	132.3	171.4	-171.4	-176.8	-173.2	117.4	3.4	109.7	E1980 L2133 C2134 D2195 S2252 H2253 N2254	E1980-R2250 IonicContact OE1-CZ 2.71Å; E1980-R2250 IonicContact OE1-NH1 3.31Å; E1980-R2250 PolarHBondContact OE1-NH1 3.29Å; E1980-R2250 IonicContact OE1-NH2 3.04Å; E1980-R2250 PolarHBondContact OE1-NH2 3.5Å; E1980-R2250 IonicContact OE2-NH2 2.77Å; L2133-R2250 PolarHBondContact O-N 3.09Å; C2134-R2250 HydrophobicContact CB-CB 4.39Å; D2195-R2250 VanDerWaalsContact CG-NH2 3.33Å; D2195-R2250 IonicContact OD1-CZ 3.56Å; D2195-R2250 IonicContact OD1-NE 3.62Å; D2195-R2250 IonicContact OD1-NH2 3.78Å; D2195-R2250 PolarHBondContact OD1-NH2 3.38Å; D2195-R2250 IonicContact OD2-CZ 3.19Å; D2195-R2250 IonicContact OD2-NE 2.73Å; D2195-R2250 PolarHBondContact OD2-NE 3.45Å; D2195-R2250 IonicContact OD2-NH2 3.06Å; D2195-R2250 PolarHBondContact OD2-NH2 3.26Å; R2250-S2252 VanDerWaalsContact C-N 3.3Å; R2250-S2252 PolarHBondContact O-N 3.33Å; R2250-H2253 HydrophobicContact CB-CB 4.24Å; R2250-H2253 WeakPolarHBondContact O-CA 3.48Å; R2250-H2253 WeakPolarHBondContact O-CB 3.24Å; R2250-H2253 PolarHBondContact O-N 3.41Å; R2250-N2254 PolarHBondContact O-N 3.04Å
2251	T	78.9	Confident	80.2	Confident	95 Å²	95	45 Å²	45	58%	0.583	23%	0.23	S	C	*	.	H	α-helix	trans	-53.5	-44.8	-171.4	47.5	0	0	0	0	112.6	L2249 H2253 N2254	L2249-T2251 PolarHBondContact O-N 3.46Å; T2251-H2253 VanDerWaalsContact C-N 3.26Å; T2251-H2253 PolarHBondContact O-N 2.96Å; T2251-N2254 PolarHBondContact O-N 3.04Å
2252	S	82.1	Confident	80.2	Confident	8 Å²	8	49.2 Å²	49.2	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-33.3	175.7	59.6	0	0	0	0	113.6	D2194 D2195 R2250	D2194-S2252 VanDerWaalsContact O-CB 3.24Å; D2194-S2252 WeakPolarHBondContact O-CB 3.49Å; D2195-S2252 WeakPolarHBondContact OD2-CB 3.46Å; D2195-S2252 PolarHBondContact OD2-OG 2.9Å; R2250-S2252 VanDerWaalsContact C-N 3.3Å; R2250-S2252 PolarHBondContact O-N 3.33Å
2253	H	87.8	Confident	80.2	Confident	2 Å²	2	51 Å²	51	1%	0.009	26%	0.261	C	S	.	.	H	α-helix	trans	-82	-27.6	178.8	-67.7	167.2	0	0	0	113.4	M2135 W2137 L2249 R2250 T2251 I2256 L2257	M2135-H2253 HydrophobicContact CE-CB 3.54Å; M2135-H2253 VanDerWaalsContact CE-O 3.23Å; M2135-H2253 WeakPolarHBondContact CE-O 3.46Å; M2135-H2253 PolarHBondContact N-ND1 3.39Å; M2135-H2253 PolarHBondContact O-CE1 3.01Å; W2137-H2253 AromaticContact CD1-CE1 3.94Å; L2249-H2253 HydrophobicContact CD1-CB 4.17Å; L2249-H2253 HydrophobicContact CD2-CB 3.99Å; L2249-H2253 HydrophobicContact CG-CB 3.8Å; R2250-H2253 HydrophobicContact CB-CB 4.24Å; R2250-H2253 WeakPolarHBondContact O-CA 3.48Å; R2250-H2253 WeakPolarHBondContact O-CB 3.24Å; R2250-H2253 PolarHBondContact O-N 3.41Å; T2251-H2253 VanDerWaalsContact C-N 3.26Å; T2251-H2253 PolarHBondContact O-N 2.96Å; H2253-I2256 PolarHBondContact O-N 2.5Å; H2253-L2257 PolarHBondContact O-N 2.95Å
2254	N	84.9	Confident	80.3	Confident	41 Å²	41	53 Å²	53	22%	0.219	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-44.5	176.8	-166.3	-33.5	0	0	0	110.9	L2249 R2250 T2251 I2256 L2257 K2258 Y2268	L2249-N2254 HydrophobicContact CD2-CB 4.47Å; R2250-N2254 PolarHBondContact O-N 3.04Å; T2251-N2254 PolarHBondContact O-N 3.04Å; N2254-I2256 VanDerWaalsContact C-N 3.34Å; N2254-I2256 PolarHBondContact O-N 2.99Å; N2254-L2257 PolarHBondContact O-N 3.07Å; N2254-K2258 PolarHBondContact O-N 2.86Å; N2254-Y2268 PolarHBondContact OD1-OH 3.3Å
2255	Y	84	Confident	80.9	Confident	149 Å²	149	61 Å²	61	58%	0.584	29%	0.292	S	S	*	.	H	α-helix	trans	-58	-44	173.7	-177.3	-99.6	0	0	0	112.8	L2257 K2258 N2259	Y2255-L2257 PolarHBondContact O-N 3.36Å; Y2255-K2258 PolarHBondContact O-N 3.22Å; Y2255-N2259 VanDerWaalsContact CE1-ND2 3.29Å; Y2255-N2259 WeakPolarHBondContact CE1-ND2 3.34Å; Y2255-N2259 PolarHBondContact O-N 3.31Å
2256	I	87.9	Confident	81.7	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-44.3	176.5	-64.2	167.8	0	0	0	111	M2135 I2188 L2193 V2208 H2253 N2254 N2259 V2260	M2135-I2256 HydrophobicContact CE-CB 3.78Å; M2135-I2256 HydrophobicContact CE-CD1 4.44Å; M2135-I2256 HydrophobicContact CE-CG2 3.72Å; I2188-I2256 HydrophobicContact CD1-CG2 4.26Å; L2193-I2256 HydrophobicContact CD1-CD1 4.23Å; V2208-I2256 HydrophobicContact CG1-CD1 4.39Å; V2208-I2256 HydrophobicContact CG1-CG2 3.61Å; V2208-I2256 HydrophobicContact CG2-CD1 3.81Å; V2208-I2256 HydrophobicContact CG2-CG1 4.38Å; H2253-I2256 PolarHBondContact O-N 2.5Å; N2254-I2256 VanDerWaalsContact C-N 3.34Å; N2254-I2256 PolarHBondContact O-N 2.99Å; I2256-N2259 PolarHBondContact O-N 3.47Å; I2256-V2260 WeakPolarHBondContact O-CG2 3.17Å; I2256-V2260 PolarHBondContact O-N 3.29Å; I2256-V2260 VanDerWaalsContact O-N 3.1Å
2257	L	88.5	Confident	82.7	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-66.1	-38.4	-178.8	-172.1	66	0	0	0	112.1	Y2124 V2243 L2249 H2253 N2254 Y2255 N2259 V2260 A2261	Y2124-L2257 HydrophobicContact CD1-CD1 3.97Å; Y2124-L2257 HydrophobicContact CD1-CD2 3.87Å; Y2124-L2257 HydrophobicContact CD2-CD1 4.38Å; Y2124-L2257 HydrophobicContact CE1-CD2 3.57Å; Y2124-L2257 HydrophobicContact CE2-CD2 4.35Å; Y2124-L2257 HydrophobicContact CG-CD1 3.9Å; Y2124-L2257 HydrophobicContact CG-CD2 4.39Å; V2243-L2257 HydrophobicContact CG2-CD1 4.07Å; V2243-L2257 HydrophobicContact CG2-CD2 4.37Å; V2243-L2257 HydrophobicContact CG2-CG 4.42Å; L2249-L2257 HydrophobicContact CD2-CB 4.16Å; L2249-L2257 HydrophobicContact CD2-CD2 3.89Å; H2253-L2257 PolarHBondContact O-N 2.95Å; N2254-L2257 PolarHBondContact O-N 3.07Å; Y2255-L2257 PolarHBondContact O-N 3.36Å; L2257-N2259 PolarHBondContact O-N 2.93Å; L2257-V2260 PolarHBondContact O-N 3.15Å; L2257-A2261 PolarHBondContact O-N 3.37Å
2258	K	86.3	Confident	83.2	Confident	93 Å²	93	56.8 Å²	56.8	40%	0.404	26%	0.261	S	S	.	.	H	α-helix	trans	-56.6	-48.4	172.9	-176	-178.2	176	-177.7	0	111.1	N2254 Y2255 V2260 A2261 E2262 Y2268	N2254-K2258 PolarHBondContact O-N 2.86Å; Y2255-K2258 PolarHBondContact O-N 3.22Å; K2258-V2260 VanDerWaalsContact C-N 3.3Å; K2258-V2260 PolarHBondContact O-N 2.82Å; K2258-A2261 PolarHBondContact O-N 2.99Å; K2258-E2262 VanDerWaalsContact CE-OE1 3.27Å; K2258-E2262 WeakPolarHBondContact CE-OE1 3.2Å; K2258-E2262 WeakPolarHBondContact O-CG 3.43Å; K2258-E2262 PolarHBondContact O-N 2.95Å; K2258-Y2268 HydrophobicContact CG-CE1 4.3Å
2259	N	86	Confident	83.9	Confident	44 Å²	44	54.2 Å²	54.2	24%	0.235	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-36	177.2	-69.4	-14.4	0	0	0	112.5	I2188 Y2255 I2256 L2257 L2263	I2188-N2259 HydrophobicContact CG2-CB 4.25Å; Y2255-N2259 VanDerWaalsContact CE1-ND2 3.29Å; Y2255-N2259 WeakPolarHBondContact CE1-ND2 3.34Å; Y2255-N2259 PolarHBondContact O-N 3.31Å; I2256-N2259 PolarHBondContact O-N 3.47Å; L2257-N2259 PolarHBondContact O-N 2.93Å; N2259-L2263 VanDerWaalsContact O-CB 3.29Å; N2259-L2263 WeakPolarHBondContact O-CB 3.32Å; N2259-L2263 PolarHBondContact O-N 2.89Å
2260	V	87.4	Confident	84.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-68.1	-41.4	175.4	175.6	0	0	0	0	112.2	T2102 L2122 I2188 I2256 L2257 K2258 L2263 R2264	T2102-V2260 HydrophobicContact CG2-CG1 4.04Å; L2122-V2260 HydrophobicContact CD2-CG1 4.07Å; I2188-V2260 HydrophobicContact CD1-CG2 3.19Å; I2188-V2260 HydrophobicContact CG1-CG2 3.97Å; I2256-V2260 WeakPolarHBondContact O-CG2 3.17Å; I2256-V2260 PolarHBondContact O-N 3.29Å; I2256-V2260 VanDerWaalsContact O-N 3.1Å; L2257-V2260 PolarHBondContact O-N 3.15Å; K2258-V2260 VanDerWaalsContact C-N 3.3Å; K2258-V2260 PolarHBondContact O-N 2.82Å; V2260-L2263 PolarHBondContact O-N 2.73Å; V2260-R2264 WeakPolarHBondContact O-CG 3.22Å; V2260-R2264 PolarHBondContact O-N 2.89Å; V2260-R2264 VanDerWaalsContact O-N 3.1Å
2261	A	87.1	Confident	84.4	Confident	2 Å²	2	58.1 Å²	58.1	2%	0.017	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-41.8	177.8	0	0	0	0	0	111.4	V2243 L2257 K2258 R2264 R2265 A2266 Y2268	V2243-A2261 HydrophobicContact CG1-CB 3.98Å; L2257-A2261 PolarHBondContact O-N 3.37Å; K2258-A2261 PolarHBondContact O-N 2.99Å; A2261-R2264 PolarHBondContact O-N 3.16Å; A2261-R2265 PolarHBondContact O-N 2.71Å; A2261-A2266 HydrophobicContact CB-CB 4.42Å; A2261-A2266 PolarHBondContact O-N 3.37Å; A2261-Y2268 HydrophobicContact CB-CD2 3.93Å; A2261-Y2268 HydrophobicContact CB-CG 4.34Å
2262	E	86.4	Confident	84.7	Confident	120 Å²	120	55.9 Å²	55.9	56%	0.561	24%	0.244	S	C	*	.	H	α-helix	trans	-64.6	-46.7	174.7	-71.9	178.3	-172.5	0	0	111.8	K2258 R2264 R2265	K2258-E2262 VanDerWaalsContact CE-OE1 3.27Å; K2258-E2262 WeakPolarHBondContact CE-OE1 3.2Å; K2258-E2262 WeakPolarHBondContact O-CG 3.43Å; K2258-E2262 PolarHBondContact O-N 2.95Å; E2262-R2264 PolarHBondContact O-N 2.79Å; E2262-R2265 PolarHBondContact O-N 3.33Å; E2262-R2265 VanDerWaalsContact O-N 3.14Å
2263	L	86	Confident	84.9	Confident	107 Å²	107	58.9 Å²	58.9	56%	0.56	26%	0.256	S	S	*	.	H	α-helix	trans	-57.4	-35.6	177.5	-175.5	68.4	0	0	0	112.4	N2259 V2260	N2259-L2263 VanDerWaalsContact O-CB 3.29Å; N2259-L2263 WeakPolarHBondContact O-CB 3.32Å; N2259-L2263 PolarHBondContact O-N 2.89Å; V2260-L2263 PolarHBondContact O-N 2.73Å
2264	R	83.7	Confident	84.7	Confident	43 Å²	43	62.7 Å²	62.7	16%	0.162	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	2.2	-178.4	-63.6	-68.8	177.9	-179.7	-8.8	114.3	E2184 H2212 V2260 A2261 E2262 A2266	E2184-R2264 VanDerWaalsContact CD-NH1 3.31Å; E2184-R2264 IonicContact OE1-CZ 3.7Å; E2184-R2264 IonicContact OE1-NH1 3.13Å; E2184-R2264 PolarHBondContact OE1-NH1 3.05Å; E2184-R2264 IonicContact OE1-NH2 2.66Å; E2184-R2264 PolarHBondContact OE1-NH2 2.92Å; E2184-R2264 IonicContact OE2-CZ 2.73Å; E2184-R2264 IonicContact OE2-NH1 2.64Å; E2184-R2264 PolarHBondContact OE2-NH1 3.12Å; E2184-R2264 IonicContact OE2-NH2 3.36Å; E2184-R2264 PolarHBondContact OE2-NH2 2.77Å; H2212-R2264 PolarHBondContact CD2-NH1 3.39Å; V2260-R2264 WeakPolarHBondContact O-CG 3.22Å; V2260-R2264 PolarHBondContact O-N 2.89Å; V2260-R2264 VanDerWaalsContact O-N 3.1Å; A2261-R2264 PolarHBondContact O-N 3.16Å; E2262-R2264 PolarHBondContact O-N 2.79Å; R2264-A2266 PolarHBondContact O-N 3.5Å
2265	R	85.5	Confident	84.7	Confident	206 Å²	206	64.2 Å²	64.2	78%	0.777	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	38.4	-174	-58.9	-179.3	176.9	170.6	-0.6	113	A2261 E2262	A2261-R2265 PolarHBondContact O-N 2.71Å; E2262-R2265 PolarHBondContact O-N 3.33Å; E2262-R2265 VanDerWaalsContact O-N 3.14Å
2266	A	82.7	Confident	84.7	Confident	2 Å²	2	57.7 Å²	57.7	2%	0.017	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-78.1	166.2	177	0	0	0	0	0	111.6	G2120 L2122 A2261 R2264	G2120-A2266 CarbonylContact O-C 3.57Å; G2120-A2266 VanDerWaalsContact O-CA 3.3Å; G2120-A2266 WeakPolarHBondContact O-CA 3.24Å; L2122-A2266 HydrophobicContact CB-CB 3.83Å; L2122-A2266 HydrophobicContact CD2-CB 4.49Å; A2261-A2266 HydrophobicContact CB-CB 4.42Å; A2261-A2266 PolarHBondContact O-N 3.37Å; R2264-A2266 PolarHBondContact O-N 3.5Å
2267	F	81.2	Confident	84.5	Confident	55 Å²	55	62.2 Å²	62.2	24%	0.241	27%	0.272	C	S	.	.			trans	-72.9	128.6	165.8	-175.3	-93.7	0	0	0	109.3	R2116 R2119 G2120 V2121	R2116-F2267 HydrophobicContact CB-CD1 4.4Å; R2116-F2267 HydrophobicContact CB-CD2 3.82Å; R2116-F2267 HydrophobicContact CB-CE2 4.1Å; R2116-F2267 HydrophobicContact CB-CG 3.98Å; R2119-F2267 HydrophobicContact CB-CB 4.31Å; G2120-F2267 PolarHBondContact O-N 3.31Å; V2121-F2267 HydrophobicContact CG2-CB 4.5Å
2268	Y	72.7	Confident	84.1	Confident	73 Å²	73	67.7 Å²	67.7	29%	0.286	30%	0.296	S	S	.	.			trans	-130.4	0	178.4	-173.6	-98.8	0	0	0	110.1	V2243 S2244 H2245 N2254 K2258 A2261	V2243-Y2268 HydrophobicContact CG1-CD2 3.52Å; V2243-Y2268 HydrophobicContact CG1-CE2 4.17Å; S2244-Y2268 WeakPolarHBondContact CA-OXT 3.39Å; H2245-Y2268 HydrophobicContact CB-CE1 4.35Å; H2245-Y2268 AromaticContact CD2-CE1 3.68Å; H2245-Y2268 PolarHBondContact N-OXT 3.49Å; N2254-Y2268 PolarHBondContact OD1-OH 3.3Å; K2258-Y2268 HydrophobicContact CG-CE1 4.3Å; A2261-Y2268 HydrophobicContact CB-CD2 3.93Å; A2261-Y2268 HydrophobicContact CB-CG 4.34Å

Retrieved 2,268 of 2,268 residues in 1249.2 ms (Link to these results)

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